2-{[2-(4-chlorophenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-(2-fluorophenyl)acetamide
Chemical Structure Depiction of
2-{[2-(4-chlorophenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-(2-fluorophenyl)acetamide
2-{[2-(4-chlorophenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-(2-fluorophenyl)acetamide
Compound characteristics
Compound ID: | C683-0472 |
Compound Name: | 2-{[2-(4-chlorophenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-(2-fluorophenyl)acetamide |
Molecular Weight: | 477.94 |
Molecular Formula: | C25 H17 Cl F N3 O2 S |
Smiles: | C1c2ccccc2Oc2c1c(nc(c1ccc(cc1)[Cl])n2)SCC(Nc1ccccc1F)=O |
Stereo: | ACHIRAL |
logP: | 7.0462 |
logD: | 7.0431 |
logSw: | -6.5575 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 48.582 |
InChI Key: | YDFJZMJXGGTLTP-UHFFFAOYSA-N |