What is the molecular formula of Dipyridamole?

Dipyridamole has a molecular formula of C 24 H 40 N 8 O 4

What is the InChI Key of Dipyridamole molecule?

The InChI Key of Dipyridamole is: IZEKFCXSFNUWAM-UHFFFAOYSA-N.

What is the molecular weight of Dipyridamole?

Dipyridamole presents a molecular weight of 504.626 g/mol.

Dipyridamole

A summary of the most common chemical descriptors (InChI Key and SMILES codes) for Dipyridamole are summarized together with 3D and 2D structures and relevant physico-chemical properties.

Table of Contents

1. What is Dipyridamole?
2. 3D Structure
3. Cartesian coordinates
4. 2D Drawing
5. Molecule descriptors
6. Physico-Chemical properties

What is the Dipyridamole?

The molecule Dipyridamole presents a molecular formula of C₂₄H₄₀N₈O₄ and its IUPAC name is 2-[[2-[bis(2-hydroxyethyl)amino]-4,8-di(piperidin-1-yl)pyrimido[5,4-d]pyrimidin-6-yl]-(2-hydroxyethyl)amino]ethanol.

Dipyridamole is a molecule used in medicine as an antiplatelet agent. It lies as a phosphodiesterase inhibitor. Dipyridamole inhibits the action of phosphodiesterase, which is an enzyme that breaks down cyclic adenosine monophosphate (cAMP). cAMP is a molecule that participes in many cellular processes, including platelet aggregation..

Dipyridamole was first synthesized in 1957. It is used clinically to prevent thrombosis (blood clots). It is often used in combination with aspirin. Dipyridamole is well tolerated and has few side effects. The most common side effects are headache and gastrointestinal upset..

Dipyridamole has a number of mechanisms of action. It inhibits platelet aggregation by blocking the release of adenosine from platelets. Adenosine is a molecule that promotes platelet aggregation. Dipyridamole also inhibits the metabolism of adenosine, which leads to an accumulation of adenosine and a further inhibition of platelet aggregation. In addition, dipyridamole potentiates the action of aspirin by inhibiting the synthesis of thromboxane A2, a molecule that promotes platelet aggregation..

Dipyridamole is an effective antiplatelet agent. It is safe and well tolerated. Dipyridamole has a number of mechanisms of action, which make it a useful agent for the prevention of thrombosis..

3D structure

Cartesian coordinates

Geometry of Dipyridamole in x, y and z coordinates (Å units) to copy/paste elsewhere. Generated with Open Babel software.

2D drawing

Dipyridamole IZEKFCXSFNUWAM-UHFFFAOYSA-N chemical compound 2D structure molecule svg — Dipyridamole

Molecule descriptors

IUPAC name	2-[[2-[bis(2-hydroxyethyl)amino]-4,8-di(piperidin-1-yl)pyrimido[5,4-d]pyrimidin-6-yl]-(2-hydroxyethyl)amino]ethanol
InChI code	InChI=1S/C24H40N8O4/c33-15-11-31(12-16-34)23-26-20-19(21(27-23)29-7-3-1-4-8-29)25-24(32(13-17-35)14-18-36)28-22(20)30-9-5-2-6-10-30/h33-36H,1-18H2
InChI Key	IZEKFCXSFNUWAM-UHFFFAOYSA-N
SMILES	OCCN(CCO)c1nc(N2CCCCC2)c2nc(N(CCO)CCO)nc(N3CCCCC3)c2n1

Other names (synonyms)

IUPAC nomenclature provides a standardized method for naming chemical compounds. Although this system is widely used in chemistry, many chemical compounds have also other names commonly used in different contexts. These synonyms can come from a variety of sources and are used for a variety of purposes.

One common source of synonyms for chemical compounds is the common or trivial names, assigned on the basis of appearance, properties, or origin of the molecule.

Another source of synonyms are historical or obsolete names employed in the past, however replaced nowadays by more modern or standardized names.

In addition to common and historical names, chemical compounds may also have synonyms that are specific to a particular field or industry.

(3E)-3-[[(1S,4aS,8aS)-Decahydro-5,5,8a-trimethyl-2-methylene-1-naphthalenyl]methylene]dihydro-5-methoxy-2(3H)3-[(1E)-2-[(1S,4aS,8aS)-Decahydro-5,5,8a-trimethyl-2-methylene-1-naphthalenyl]ethenyl]furan; (+)-Coronarin E-furanone; Coronarin D methyl ethe
2,2'',2'''-[4,8-Dipiperidinopyrimido[5,4-d]pyrimidine-2,6-diyl]dinitrilotetraethanol
2,2',2'',2'''-((4,8-Di(piperidin-1-yl)pyrimido[5,4-d]-pyrimidine-2,6-diyl)bis(azanetriyl))tetraethanol
2,2',2'',2'''-((4,8-Di(piperidin-1-yl)pyrimido[5,4-d]pyrimidine-2,6-diyl)bis(azanetriyl))tetraethanol
2,2',2'',2'''-((4,8-Dipiperidinopyrimido(5,4-d)pyrimidine-2,6-diyl)dinitrilo)tetraethanol
2,2',2'',2'''-((4,8-di(piperidin-1-yl)pyrimido[5,4-d]pyrimidine-2,6-diyl)bis(azanetriyl))tetrakis(ethan-1-ol)
2,2',2'',2'''-(4,8-Dipiperidinopyrimido(5,4-d)pyrimidine-2,6-diyl)dinitrilotetraethanol
2,2',2'',2'''-(4,8-di(piperidin-1-yl)pyrimido[5,4-d]pyrimidine-2,6-diyl)bis(azanetriyl)tetraethanol
2,2',2'',2'''-[(4,8-Dipiperidinylpyrimido[5,4-d]pyrimidine-2,6-diyl)dinitrilo]tetraethanol
2,2',2'',2'''-[(4,8-Dipiperidinylpyrimido[5,4-d]pyrimidine-2,6-diyl)dinitrilo]tetrakisethanol
2,2',2'',2'''-[(4,8-dipiperidin-1-ylpyrimido[5,4-d]pyrimidine-2,6-diyl)dinitrilo]tetraethanol
2,2',2'',2'''-{[4,8-di(piperidin-1-yl)pyrimido[5,4-d]pyrimidine-2,6-diyl]dinitrilo}tetraethanol
2,6-Bis(diethanolamine)-4,8-dipiperidinopyrimido[5,4-d]pyrimidine
2,6-Bis(diethanolamino)-4,8-dipiperidinopyrimido(5,4-d)pyrimidine
2,6-Bis(diethanolamino)-4,8-dipiperidinopyrimido-[5,4-d]pyrimidin
2,6-Bis(diethanolamino)-4,8-dipiperidinopyrimido[5,4-d]pyrimidine
2,8-dipiperidinopyrimido[5,4-d]pyrimidine
2-[[2-(bis(2-hydroxyethyl)amino)-4,8-di(piperidin-1-yl)pyrimido[6,5-e]pyrimidin-
58-32-2
64ALC7F90C
A828156
A831828
AB00051974
AB00051974-18
AB00051974-19
AB00051974_20
AB00051974_21
AC-18100
AC-30804
AGGRENOX COMPONENT DIPYRIDAMOLE
AMY40468
Agilease
Anginal
Apricor
B01AC07
B1933
BBL027781
BCP26947
BCP9000613
BCPP000256
BDBM23620
BIM-0050449.0001
BPBio1_000270
BRN 0068373
BSPBio_000244
BSPBio_001554
BSPBio_001924
CCG-40190
Cardioflux
Cardoxil
Cardoxin
Cleridium
Cleridium 150
Coribon
Coridil
Coronarine
Corosan
Coroxin
Curantyl
Chilcolan
D 9766
D00302
DB00975
DIPYRIDAMOLE COMPONENT OF AGGRENOX
DSSTox_CID_20668
DSSTox_GSID_40668
DSSTox_RID_79531
Dipiridamol
Dipridacot
Dipyridamine
Dipyridamol
Dipyridamole
Dipyridamole (JP17/USP/INN)
Dipyridamole (Persantine)
Dipyridamolum
Dipyridan
Dipyudamine
DivK1c_000696
Dypyridamol
Dypyridamole
EN300-70723
EU-0100464
Ethanol, 2,2',2'',2'''-((4,8-di-1-piperidinylpyrimido(5,4-d)pyrimidine-2,6-diyl)dinitrilo)tetrakis-
Ethanol, 2,2',2'',2'''-((4,8-dipiperidinopyrimido(5,4-d)pyrimidine-2,6-diyl)dinitrilo)tetra-
Ethanol, 2,2',2'',2'''-(4,8-dipiperidinopyrimido(5,4-d)pyrimidine-2,6-diyldinitrilo)tetra-
Ethanol, 2,2',2'',2'''-[(4,8-di-1-piperidinylpyrimido[5,4-d]pyrimidine-2,6-diyl)dinitrilo]tetrakis-
Ethanol, 2,2',2',2'''-((4,8-di-1-iperidinylpyrimido(5,4-d)pyrimidine-2,6-diyl)dinitrilo)tetrakis-
Ethanol,2',2'',2'''-(4,8-dipiperidinopyrimido[5,4-d]pyrimidine-2,6-diyldinitrilo)tetra-
Ethanol,2',2'',2'''-[(4,8-di-1-piperidinylpyrimido[5,4-d]pyrimidine-2,6-diyl)dinitrilo]tetrakis-
Ethanol,2',2'',2'''-[(4,8-dipiperidinopyrimido[5,4-d]pyrimidine-2,6-diyl)dinitrilo]tetra-
Ethanol,2,2',2'',2'''-[(4,8-di-1-piperidinylpyrimido[5,4-d]pyrimidine-2,6-diyl)dinitrilo]tetrakis-
FT-0603242
GTPL4807
Gulliostin
H9F
HMS1568M06
HMS1791N16
HMS1920I10
HMS1989N16
HMS2089N15
HMS2091O18
HMS2095M06
HMS2232E19
HMS3259C03
HMS3261M10
HMS3266J17
HMS3371J03
HMS3402N16
HMS3411B03
HMS3655I20
HMS3675B03
HMS3712M06
HMS3742O03
HMS3867F13
HMS502C18
HS-0041
HY-B0312
IDI1_000696
IZEKFCXSFNUWAM-UHFFFAOYSA-
Iv Persantine
Justpertin
KBio1_000696
KBio2_001484
KBio2_004052
KBio2_006620
KBio3_001144
KBioGR_001123
KBioSS_001484
Kurantil
LP00464
Lopac-D-9766
Lopac0_000464
MFCD00010555
MLS000028420
MLS001076306
MLS001333724
MLS002548866
NC00448
NCGC00015385-01
NCGC00015385-02
NCGC00015385-03
NCGC00015385-04
NCGC00015385-05
NCGC00015385-06
NCGC00015385-07
NCGC00015385-08
NCGC00015385-09
NCGC00015385-10
NCGC00015385-11
NCGC00015385-12
NCGC00015385-13
NCGC00015385-14
NCGC00015385-15
NCGC00015385-16
NCGC00015385-17
NCGC00015385-18
NCGC00015385-29
NCGC00023914-02
NCGC00023914-04
NCGC00023914-05
NCGC00023914-06
NCGC00023914-07
NCGC00023914-08
NCGC00023914-09
NCGC00023914-10
NCGC00023914-11
NCGC00261149-01
NCI60_005689
NINDS_000696
NSC 515776
NSC-515776
NSC-619103
NSC-756743
NSC515776
NSC756743
Natyl
O10551
Opera_ID_494
Peridamol
Permiltin
Permole
Persantin
Persantine
Pharmakon1600-01500259
Piroan
Prandiol
Prandiol 75
Prestwick0_000142
Prestwick1_000142
Prestwick2_000142
Prestwick3_000142
Prestwick_145
Protangix
Pyrimido(5,4-d)pyrimidine, 2,6-bis(bis(2-hydroxyethyl)amino)-4,8-dipiperidino-
Q419374
RA 8
RA-8
SBI-0050449.P004
SDCCGSBI-0050449.P005
SMP2_000208
SMR000058382
SPECTRUM1500259
SR-01000003065
SR-01000003065-2
SR-01000003065-4
SR-01000003065-5
SR-01000003065-7
STL377790
SW196456-3
Stenocardil
Stenocardiol
Stimolcardio
Thymidine,6-dihydro-6-methoxy-
Tocris-0691
Usaf Ge-12
W-105400
WLN: T66 BN DN GN INJ CCN HCN E- AT6NTJ B2Q F2Q& J- AT6NTJ B2Q F2Q
Z1259192074
cid_3108
dipyridamole
s1895

Reference codes for other databases

There exist several different chemical codes commonly used in orded to identify molecules:

CAS number (Chemical Abstracts Service Registry Number) is a unique identifier is assigned to every chemical compound indexed in the CAS database.
Beilstein: The Beilstein database is a comprehensive source of information on organic chemistry, including information on chemical structures, properties, and reactions. The Beilstein database assigns unique identifiers which can be used to identify compounds in scientific literature and other sources.
ChEBI (Chemical Entities of Biological Interest): ChEBI is a database of small chemical molecules that are of interest in the field of biology.
PubChem CID (Compound Identifier): PubChem is a database of chemical compounds that is maintained by the National Institutes of Health (NIH).
RTECS number (Registry of Toxic Effects of Chemical Substances): The RTECS is a database of information on the toxic effects of chemicals, including information on their structures and properties.
ChEMBL (Compound Bioactivity Data): ChEMBL is a database of bioactivity data for small molecules, including information on their properties and structures.
CompTox Dashboard (Environmental Protection Agency): The CompTox Dashboard is a database of information on the toxicology and environmental effects of chemicals.

ZINC643046
CAS-58-32-2
UNII-64ALC7F90C
AKOS000509426
BRD-K86301799-001-04-1
BRD-K86301799-001-19-9
BRD-K86301799-001-24-9
DTXSID6040668
CHEMBL932
CHEBI:4653
Tox21_110133
Tox21_500464
Tox21_110133_1
EINECS 200-374-7
SPBio_001003
SPBio_002183
UPCMLD-DP072
UPCMLD-DP072:001
SCHEMBL16119
Spectrum_001004
Spectrum2_000972
Spectrum3_000402
Spectrum4_000522
Spectrum5_000839

Physico-Chemical properties

IUPAC name	2-[[2-[bis(2-hydroxyethyl)amino]-4,8-di(piperidin-1-yl)pyrimido[5,4-d]pyrimidin-6-yl]-(2-hydroxyethyl)amino]ethanol
Molecular formula	C₂₄H₄₀N₈O₄
Molecular weight	504.626
Melting point (ºC)
Boiling point (ºC)
Density (g/cm³)
Molar refractivity	146.32
LogP	0.1
Topological polar surface area	145.4

LogP and topological polar surface area (TPSA) values were estimated using Open Babel software.

The n-octanol/water partition coeficient (K_ow) data is applied in toxicology and drug research. K_ow values are used, to guess the environmental fate of persistent organic pollutants. High partition coefficients values, tend to accumulate in the fatty tissue of organisms. Molecules with a log(K_ow) (or LogP) greater than 5 are considered to bioaccumulate.

TPSA values are the sum of the surface area over all polar atoms or molecules, mainly oxygen and nitrogen, also including hydrogen atoms.

In medicinal chemistry, TPSA is used to assess the ability of a drug to permeabilise cells.

For molecules to penetrate the blood-brain barrier (and act on receptors in the central nervous system), TPSA values below 90 Å² are required. Thus, molecules with a polar surface area greater than 140 Å² tend to be poorly permeable to cell membranes.