2-{[2-(4-fluorophenyl)-9-methyl-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-(3-methylphenyl)acetamide
Chemical Structure Depiction of
2-{[2-(4-fluorophenyl)-9-methyl-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-(3-methylphenyl)acetamide
2-{[2-(4-fluorophenyl)-9-methyl-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-(3-methylphenyl)acetamide
Compound characteristics
| Compound ID: | C683-0721 |
| Compound Name: | 2-{[2-(4-fluorophenyl)-9-methyl-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-(3-methylphenyl)acetamide |
| Molecular Weight: | 471.55 |
| Molecular Formula: | C27 H22 F N3 O2 S |
| Smiles: | Cc1cccc(c1)NC(CSc1c2Cc3cccc(C)c3Oc2nc(c2ccc(cc2)F)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 7.5125 |
| logD: | 7.5094 |
| logSw: | -5.6156 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.964 |
| InChI Key: | GXWBSCIIMWONOP-UHFFFAOYSA-N |