2-({7-[(2-fluorophenyl)methyl]-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl}sulfanyl)-N-(1,3-thiazol-2-yl)acetamide
Chemical Structure Depiction of
2-({7-[(2-fluorophenyl)methyl]-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl}sulfanyl)-N-(1,3-thiazol-2-yl)acetamide
2-({7-[(2-fluorophenyl)methyl]-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl}sulfanyl)-N-(1,3-thiazol-2-yl)acetamide
Compound characteristics
| Compound ID: | 8017-4957 |
| Compound Name: | 2-({7-[(2-fluorophenyl)methyl]-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl}sulfanyl)-N-(1,3-thiazol-2-yl)acetamide |
| Molecular Weight: | 460.51 |
| Molecular Formula: | C19 H17 F N6 O3 S2 |
| Smiles: | CN1C(c2c(nc(n2Cc2ccccc2F)SCC(Nc2nccs2)=O)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3052 |
| logD: | 3.3047 |
| logSw: | -3.5404 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.642 |
| InChI Key: | CKTODSICNIZIPF-UHFFFAOYSA-N |