N-(2-chlorophenyl)-2-{[2-(4-fluorophenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2-chlorophenyl)-2-{[2-(4-fluorophenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}acetamide
N-(2-chlorophenyl)-2-{[2-(4-fluorophenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | C683-0504 |
| Compound Name: | N-(2-chlorophenyl)-2-{[2-(4-fluorophenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}acetamide |
| Molecular Weight: | 477.94 |
| Molecular Formula: | C25 H17 Cl F N3 O2 S |
| Smiles: | C1c2ccccc2Oc2c1c(nc(c1ccc(cc1)F)n2)SCC(Nc1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 6.7512 |
| logD: | 6.7481 |
| logSw: | -6.393 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.582 |
| InChI Key: | CQWZHPLDDKKQQI-UHFFFAOYSA-N |