2-{[2-(4-chlorophenyl)-9-methyl-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-phenylacetamide
Chemical Structure Depiction of
2-{[2-(4-chlorophenyl)-9-methyl-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-phenylacetamide
2-{[2-(4-chlorophenyl)-9-methyl-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-phenylacetamide
Compound characteristics
| Compound ID: | C683-0699 |
| Compound Name: | 2-{[2-(4-chlorophenyl)-9-methyl-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-phenylacetamide |
| Molecular Weight: | 473.98 |
| Molecular Formula: | C26 H20 Cl N3 O2 S |
| Smiles: | Cc1cccc2Cc3c(nc(c4ccc(cc4)[Cl])nc3SCC(Nc3ccccc3)=O)Oc12 |
| Stereo: | ACHIRAL |
| logP: | 7.5265 |
| logD: | 7.5234 |
| logSw: | -6.4065 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.964 |
| InChI Key: | BOSJAIDABCFSKI-UHFFFAOYSA-N |