N-(4-methylphenyl)-2-({2-[4-(methylsulfanyl)phenyl]-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(4-methylphenyl)-2-({2-[4-(methylsulfanyl)phenyl]-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl}sulfanyl)acetamide
N-(4-methylphenyl)-2-({2-[4-(methylsulfanyl)phenyl]-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | C683-0579 |
| Compound Name: | N-(4-methylphenyl)-2-({2-[4-(methylsulfanyl)phenyl]-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl}sulfanyl)acetamide |
| Molecular Weight: | 485.63 |
| Molecular Formula: | C27 H23 N3 O2 S2 |
| Smiles: | Cc1ccc(cc1)NC(CSc1c2Cc3ccccc3Oc2nc(c2ccc(cc2)SC)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 7.814 |
| logD: | 7.811 |
| logSw: | -5.8581 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.28 |
| InChI Key: | QVMQVQBZKATICW-UHFFFAOYSA-N |