2-{[2-(4-ethoxyphenyl)-9-methyl-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-methyl-N-phenylacetamide
Chemical Structure Depiction of
2-{[2-(4-ethoxyphenyl)-9-methyl-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-methyl-N-phenylacetamide
2-{[2-(4-ethoxyphenyl)-9-methyl-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-methyl-N-phenylacetamide
Compound characteristics
| Compound ID: | C683-0890 |
| Compound Name: | 2-{[2-(4-ethoxyphenyl)-9-methyl-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-methyl-N-phenylacetamide |
| Molecular Weight: | 497.62 |
| Molecular Formula: | C29 H27 N3 O3 S |
| Smiles: | CCOc1ccc(cc1)c1nc2c(Cc3cccc(C)c3O2)c(n1)SCC(N(C)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.9341 |
| logD: | 6.931 |
| logSw: | -5.833 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.052 |
| InChI Key: | QITUJWJAPPNTDA-UHFFFAOYSA-N |