2-{[2-(4-chlorophenyl)-7-methyl-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-(2-methylphenyl)acetamide
Chemical Structure Depiction of
2-{[2-(4-chlorophenyl)-7-methyl-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-(2-methylphenyl)acetamide
2-{[2-(4-chlorophenyl)-7-methyl-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-(2-methylphenyl)acetamide
Compound characteristics
| Compound ID: | C683-0604 |
| Compound Name: | 2-{[2-(4-chlorophenyl)-7-methyl-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-(2-methylphenyl)acetamide |
| Molecular Weight: | 488.01 |
| Molecular Formula: | C27 H22 Cl N3 O2 S |
| Smiles: | Cc1ccc2c(Cc3c(nc(c4ccc(cc4)[Cl])nc3SCC(Nc3ccccc3C)=O)O2)c1 |
| Stereo: | ACHIRAL |
| logP: | 7.3456 |
| logD: | 7.3425 |
| logSw: | -6.3404 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.582 |
| InChI Key: | ZAXJYWWEYMBDJY-UHFFFAOYSA-N |