2-{[9-ethoxy-2-(4-methoxyphenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-phenylacetamide
Chemical Structure Depiction of
2-{[9-ethoxy-2-(4-methoxyphenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-phenylacetamide
2-{[9-ethoxy-2-(4-methoxyphenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-phenylacetamide
Compound characteristics
| Compound ID: | C683-0322 |
| Compound Name: | 2-{[9-ethoxy-2-(4-methoxyphenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-phenylacetamide |
| Molecular Weight: | 499.59 |
| Molecular Formula: | C28 H25 N3 O4 S |
| Smiles: | CCOc1cccc2Cc3c(nc(c4ccc(cc4)OC)nc3SCC(Nc3ccccc3)=O)Oc12 |
| Stereo: | ACHIRAL |
| logP: | 6.8032 |
| logD: | 6.8001 |
| logSw: | -5.8639 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.718 |
| InChI Key: | MHZQUBDFYSCGSX-UHFFFAOYSA-N |