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Dipyridamole-d20

CAT: 0926-BD182697-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0926-BD182697-01Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1189983-52-5
Smiles
N (CCO) (CCO) C1=NC2=C (C (=N1) N3C (C (C (C (C3 ([2H]) [2H]) ([2H]) [2H]) ([2H]) [2H]) ([2H]) [2H]) ([2H]) [2H]) N=C (N (CCO) CCO) N=C2N4C (C (C (C (C4 ([2H]) [2H]) ([2H]) [2H]) ([2H]) [2H]) ([2H]) [2H]) ([2H]) [2H]
Molecular Formula
C24H20D20N8O4
Molecular Weight
524.75 g/mol
Controlled
No

Chemical Information

Dipyridamole-D20 (Major)
CAS Number1189983-52-5
PubChem CID45039101
IUPAC Name2-[[2-[bis(2-hydroxyethyl)amino]-4,8-bis(2,2,3,3,4,4,5,5,6,6-decadeuteriopiperidin-1-yl)pyrimido[5,4-d]pyrimidin-6-yl]-(2-hydroxyethyl)amino]ethanol
Molecular FormulaC24H40N8O4
Molecular Weight524.7
XLogP0.7
Topological Polar Surface Area145
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count12
Rotatable Bond Count12
Heavy Atom Count36
Formal Charge0
Complexity561
SMILES
[2H]C1(C(C(N(C(C1([2H])[2H])([2H])[2H])C2=NC(=NC3=C2N=C(N=C3N4C(C(C(C(C4([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])N(CCO)CCO)N(CCO)CCO)([2H])[2H])([2H])[2H])[2H]
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/i1D2,2D2,3D2,4D2,5D2,6D2,7D2,8D2,9D2,10D2
InChIKey
IZEKFCXSFNUWAM-KHKAULECSA-N
Chemical Structure
2D Structure
2D structure of Dipyridamole-D20 (Major)
CAS: 1189983-52-5
CID: 45039101
Formula: C24H40N8O4
MW: 524.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight524.7
XLogP30.7
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count12
Rotatable Bond Count12
Exact Mass524.44278671
Monoisotopic Mass524.44278671
Topological Polar Surface Area145 Ų
Heavy Atom Count36
Formal Charge0
Complexity561
Isotope Atom Count20
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
CS-O-03047Dipyridamole-d20
TRC-D492627-1MGDipyridamole-d20 (Major)
D3754-10CDipyridamole-d20 (2,2’,2’’,2’’’-[ (4,8-Di-1-piperidinyl-d20-pyrimido[5,4-d]pyrimidine-2,6-diyl) dinitrilo]tetrakis-ethanol, NSC-515776-d20, RA-8-d20, Anginal-d20, Cardoxin-d20, Cleridium-d20, Dipyridan-d20, Natyl-d20, Peridamol-d20, Persantine-d20)
MBS6089162-01Dipyridamole-d20 (2,2',2'',2'''-[ (4,8-Di-1-piperidinyl-d20-pyrimido[5,4-d]pyrimidine-2,6-diyl) dinitrilo]tetrakis-ethanol, NSC-515776-d20, RA-8-d20, Anginal-d20, Cardoxin-d20, Cleridium-d20, Dipyridan-d20, Natyl-d20, Peridamol-d20, Persantine-d20)
B1933-SDipyridamole

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