9-(4-chlorophenyl)-8-oxo-2-(propan-2-yl)-8,9-dihydro-7H-purine-6-carboxamide
Chemical Structure Depiction of
9-(4-chlorophenyl)-8-oxo-2-(propan-2-yl)-8,9-dihydro-7H-purine-6-carboxamide
9-(4-chlorophenyl)-8-oxo-2-(propan-2-yl)-8,9-dihydro-7H-purine-6-carboxamide
Compound characteristics
Compound ID: | C926-0274 |
Compound Name: | 9-(4-chlorophenyl)-8-oxo-2-(propan-2-yl)-8,9-dihydro-7H-purine-6-carboxamide |
Molecular Weight: | 331.76 |
Molecular Formula: | C15 H14 Cl N5 O2 |
Smiles: | CC(C)c1nc(C(N)=O)c2c(n1)N(C(N2)=O)c1ccc(cc1)[Cl] |
Stereo: | ACHIRAL |
logP: | 2.3185 |
logD: | 2.3002 |
logSw: | -3.2343 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 78.882 |
InChI Key: | SUDIKEYJBXZUEW-UHFFFAOYSA-N |