N-(2-chloro-4-methylphenyl)-2-({6-oxo-9-[(oxolan-2-yl)methyl]-6,9-dihydro-1H-purin-8-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(2-chloro-4-methylphenyl)-2-({6-oxo-9-[(oxolan-2-yl)methyl]-6,9-dihydro-1H-purin-8-yl}sulfanyl)acetamide
N-(2-chloro-4-methylphenyl)-2-({6-oxo-9-[(oxolan-2-yl)methyl]-6,9-dihydro-1H-purin-8-yl}sulfanyl)acetamide
Compound characteristics
Compound ID: | G754-0486 |
Compound Name: | N-(2-chloro-4-methylphenyl)-2-({6-oxo-9-[(oxolan-2-yl)methyl]-6,9-dihydro-1H-purin-8-yl}sulfanyl)acetamide |
Molecular Weight: | 433.91 |
Molecular Formula: | C19 H20 Cl N5 O3 S |
Smiles: | Cc1ccc(c(c1)[Cl])NC(CSc1nc2C(NC=Nc2n1CC1CCCO1)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.0362 |
logD: | 2.0356 |
logSw: | -2.8817 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 78.536 |
InChI Key: | NVUKXGTYJOCEHB-GFCCVEGCSA-N |