2-{[2-(4-fluorophenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-[3-(methylsulfanyl)phenyl]acetamide
Chemical Structure Depiction of
2-{[2-(4-fluorophenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-[3-(methylsulfanyl)phenyl]acetamide
2-{[2-(4-fluorophenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-[3-(methylsulfanyl)phenyl]acetamide
Compound characteristics
| Compound ID: | C683-0517 |
| Compound Name: | 2-{[2-(4-fluorophenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-[3-(methylsulfanyl)phenyl]acetamide |
| Molecular Weight: | 489.59 |
| Molecular Formula: | C26 H20 F N3 O2 S2 |
| Smiles: | CSc1cccc(c1)NC(CSc1c2Cc3ccccc3Oc2nc(c2ccc(cc2)F)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 7.1613 |
| logD: | 7.1583 |
| logSw: | -5.742 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.28 |
| InChI Key: | WLYRLHRINOHXHL-UHFFFAOYSA-N |