N-[3-(methylsulfanyl)phenyl]-2-[(2-phenyl-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-[3-(methylsulfanyl)phenyl]-2-[(2-phenyl-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl)sulfanyl]acetamide
N-[3-(methylsulfanyl)phenyl]-2-[(2-phenyl-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | C683-0043 |
| Compound Name: | N-[3-(methylsulfanyl)phenyl]-2-[(2-phenyl-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl)sulfanyl]acetamide |
| Molecular Weight: | 471.6 |
| Molecular Formula: | C26 H21 N3 O2 S2 |
| Smiles: | CSc1cccc(c1)NC(CSc1c2Cc3ccccc3Oc2nc(c2ccccc2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 7.0272 |
| logD: | 7.0241 |
| logSw: | -5.7348 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.28 |
| InChI Key: | JKWKRMKDMOMMGS-UHFFFAOYSA-N |