N-(2-fluorophenyl)-2-[(9-methyl-6-oxo-6,9-dihydro-1H-purin-8-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(2-fluorophenyl)-2-[(9-methyl-6-oxo-6,9-dihydro-1H-purin-8-yl)sulfanyl]acetamide
N-(2-fluorophenyl)-2-[(9-methyl-6-oxo-6,9-dihydro-1H-purin-8-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | J095-0073 |
| Compound Name: | N-(2-fluorophenyl)-2-[(9-methyl-6-oxo-6,9-dihydro-1H-purin-8-yl)sulfanyl]acetamide |
| Molecular Weight: | 333.34 |
| Molecular Formula: | C14 H12 F N5 O2 S |
| Smiles: | Cn1c2c(C(NC=N2)=O)nc1SCC(Nc1ccccc1F)=O |
| Stereo: | ACHIRAL |
| logP: | 0.7335 |
| logD: | 0.7329 |
| logSw: | -2.2211 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.964 |
| InChI Key: | CIULIPSVONXXPV-UHFFFAOYSA-N |