2-[[(3,4-Dichlorophenyl)methyl]amino]-1,7-dihydro-7-[2-(4-morpholinyl)ethyl]-6H-purin-6-one-d8

Analyte Name

2-(((3,4-Dichlorophenyl)methyl)amino)-1,7-dihydro-7-(2-(4-morpholinyl)ethyl)-6H-purin-6-one-d8

Molecular Formula

C18 D8 H12 Cl2 N6 O2

Molecular Weight

431.346

Accurate Mass

430.153

SMILES

[2H]C1([2H])OC([2H])([2H])C([2H])([2H])N(CCn2cnc3NC(=NC(=O)c23)NCc4ccc(Cl)c(Cl)c4)C1([2H])[2H]

InChI

InChI=1S/C18H20Cl2N6O2/c19-13-2-1-12(9-14(13)20)10-21-18-23-16-15(17(27)24-18)26(11-22-16)4-3-25-5-7-28-8-6-25/h1-2,9,11H,3-8,10H2,(H2,21,23,24,27)/i5D2,6D2,7D2,8D2

IUPAC

2-[(3,4-dichlorophenyl)methylamino]-7-[2-(2,2,3,3,5,5,6,6-octadeuteriomorpholin-4-yl)ethyl]-3H-purin-6-one

Unlabelled CAS Number

1275582-97-2

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat