N-(3-chloro-4-fluorophenyl)-2-{[7-oxo-2-(piperidin-1-yl)-6-(propan-2-yl)-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-2-{[7-oxo-2-(piperidin-1-yl)-6-(propan-2-yl)-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}acetamide
N-(3-chloro-4-fluorophenyl)-2-{[7-oxo-2-(piperidin-1-yl)-6-(propan-2-yl)-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | L387-2436 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-2-{[7-oxo-2-(piperidin-1-yl)-6-(propan-2-yl)-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}acetamide |
| Molecular Weight: | 496.02 |
| Molecular Formula: | C21 H23 Cl F N5 O2 S2 |
| Smiles: | CC(C)N1C(=Nc2c(C1=O)sc(n2)N1CCCCC1)SCC(Nc1ccc(c(c1)[Cl])F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2493 |
| logD: | 5.2444 |
| logSw: | -5.6704 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.761 |
| InChI Key: | QCNXTKVKPCJGFG-UHFFFAOYSA-N |