2-{[2-(4-methylphenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}acetamide
Chemical Structure Depiction of
2-{[2-(4-methylphenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}acetamide
2-{[2-(4-methylphenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | C683-0533 |
| Compound Name: | 2-{[2-(4-methylphenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}acetamide |
| Molecular Weight: | 363.44 |
| Molecular Formula: | C20 H17 N3 O2 S |
| Smiles: | Cc1ccc(cc1)c1nc2c(Cc3ccccc3O2)c(n1)SCC(N)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9336 |
| logD: | 4.9306 |
| logSw: | -4.8805 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.79 |
| InChI Key: | CEBJLEWZYMGBLV-UHFFFAOYSA-N |