N-(2,4-difluorophenyl)-2-[(9-methyl-6-oxo-6,9-dihydro-1H-purin-8-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(2,4-difluorophenyl)-2-[(9-methyl-6-oxo-6,9-dihydro-1H-purin-8-yl)sulfanyl]acetamide
N-(2,4-difluorophenyl)-2-[(9-methyl-6-oxo-6,9-dihydro-1H-purin-8-yl)sulfanyl]acetamide
Compound characteristics
Compound ID: | J095-0021 |
Compound Name: | N-(2,4-difluorophenyl)-2-[(9-methyl-6-oxo-6,9-dihydro-1H-purin-8-yl)sulfanyl]acetamide |
Molecular Weight: | 351.33 |
Molecular Formula: | C14 H11 F2 N5 O2 S |
Smiles: | Cn1c2c(C(NC=N2)=O)nc1SCC(Nc1ccc(cc1F)F)=O |
Stereo: | ACHIRAL |
logP: | 0.8692 |
logD: | 0.8615 |
logSw: | -2.4212 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 70.964 |
InChI Key: | HMYGZUCBFDTOAV-UHFFFAOYSA-N |