N-(3-chloro-4-fluorophenyl)-2-{[2-(4-fluorophenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-2-{[2-(4-fluorophenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}acetamide
N-(3-chloro-4-fluorophenyl)-2-{[2-(4-fluorophenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | C683-0511 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-2-{[2-(4-fluorophenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}acetamide |
| Molecular Weight: | 495.93 |
| Molecular Formula: | C25 H16 Cl F2 N3 O2 S |
| Smiles: | C1c2ccccc2Oc2c1c(nc(c1ccc(cc1)F)n2)SCC(Nc1ccc(c(c1)[Cl])F)=O |
| Stereo: | ACHIRAL |
| logP: | 7.4305 |
| logD: | 7.4213 |
| logSw: | -6.6445 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.28 |
| InChI Key: | YBXHAARXIJYBMT-UHFFFAOYSA-N |