2-{[2-(4-chlorophenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-(3-methylphenyl)acetamide
Chemical Structure Depiction of
2-{[2-(4-chlorophenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-(3-methylphenyl)acetamide
2-{[2-(4-chlorophenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-(3-methylphenyl)acetamide
Compound characteristics
| Compound ID: | C683-0466 |
| Compound Name: | 2-{[2-(4-chlorophenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-(3-methylphenyl)acetamide |
| Molecular Weight: | 473.98 |
| Molecular Formula: | C26 H20 Cl N3 O2 S |
| Smiles: | Cc1cccc(c1)NC(CSc1c2Cc3ccccc3Oc2nc(c2ccc(cc2)[Cl])n1)=O |
| Stereo: | ACHIRAL |
| logP: | 7.626 |
| logD: | 7.6229 |
| logSw: | -6.3717 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.28 |
| InChI Key: | SEMFTPUGOVQFSD-UHFFFAOYSA-N |