2-{[2-(4-methoxyphenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-phenylacetamide
Chemical Structure Depiction of
2-{[2-(4-methoxyphenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-phenylacetamide
2-{[2-(4-methoxyphenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-phenylacetamide
Compound characteristics
| Compound ID: | C683-0252 |
| Compound Name: | 2-{[2-(4-methoxyphenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-phenylacetamide |
| Molecular Weight: | 455.53 |
| Molecular Formula: | C26 H21 N3 O3 S |
| Smiles: | COc1ccc(cc1)c1nc2c(Cc3ccccc3O2)c(n1)SCC(Nc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.462 |
| logD: | 6.4589 |
| logSw: | -5.8268 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.824 |
| InChI Key: | QIJIATYOPDPEIZ-UHFFFAOYSA-N |