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Dipyridamole
CAS: 58-32-2 | C24H40N8O4
2D Structure
3D Structure
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Basic Information
CAS Registry Number:
58-32-2
Molecular Formula:
C24H40N8O4
Molecular Mass:
504.64 g/mol
Names and Synonyms:
Dipyridamole
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-
Pyrimido[5,4-d]pyrimidine, ethanol deriv.
2,2′,2′′,2′′′-[(4,8-Di-1-piperidinylpyrimido[5,4-d]pyrimidine-2,6-diyl)dinitrilo]tetrakis[ethanol]
RA 8
2,6-Bis(diethanolamino)-4,8-dipiperidinopyrimido[5,4-d]pyrimidine
2,2′,2′′,2′′′-[[4,8-Dipiperidinopyrimido(5,4-d)pyrimidine-2,6-diyl]dinitrilo]tetraethanol
Dipyridamine
Dipyridamol
Dipyridamole
Persantin
Persantine
Anginal
Cardoxin
Curantyl
Kurantil
Stenocardil
Apricor
Cardioflux
Stimolcardio
Coribon
Corosan
Coroxin
Prandiol
Coronarine
Cardoxil
Gulliostin
Protangix
Piroan
Peridamol
Natyl
Coridil
Cleridium
NSC 515776
Dipyridan
NSC 619103
2,2′,2′′,2′′′-[[4,8-Di(piperidin-1-yl)pyrimido[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))tetraethanol
2-([6-[Bis(2-hydroxyethyl)amino]-4,8-bis(piperidin-1-yl)-[1,3]diazino[5,4-d]pyrimidin-2-yl](2-hydroxyethyl)amino)ethan-1-ol
2-[[2-[Bis(2-hydroxyethyl)amino]-4,8-di(piperidin-1-yl)pyrimido[5,4-d]pyrimidin-6-yl]-(2-hydroxyethyl)amino]ethanol
Identifiers:
SMILES:
OCCN(CCO)c1nc(N2CCCCC2)c2nc(N(CCO)CCO)nc(N3CCCCC3)c2n1
InChI:
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
Key Properties
Melting Point
163 °C
CAS Common Chemistry
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 504.64 g/mol | CAS Common Chemistry |
| 504.6360000000004 g/mol | RDKit | |
| 504.31725176000003 g/mol | RDKit | |
| Canonical SMILES | OCCN(C=1N=C2C(N=C(N=C2N3CCCCC3)N(CCO)CCO)=C(N1)N4CCCCC4)CCO | CAS Common Chemistry |
| InChI | 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 | CAS Common Chemistry |
| InChI Key | InChIKey=IZEKFCXSFNUWAM-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 163 °C | CAS Common Chemistry |
| Name | Dipyridamole | CAS Common Chemistry |
| Heavy Atom Count | 36 | RDKit |
| Hydrogen Bond Acceptors | 12 | RDKit |
| Hydrogen Bond Donors | 4 | RDKit |
| Rotatable Bonds | 12 | RDKit |
| Aromatic Ring Count | 2 | RDKit |
| Topological Polar Surface Area | 145.44 Ų | RDKit |
| LogP | -0.017599999999997396 | RDKit |
| Molar Refractivity | 140.02519999999993 | RDKit |
