2-{[2-(4-methoxyphenyl)-9-methyl-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-methyl-N-phenylacetamide
Chemical Structure Depiction of
2-{[2-(4-methoxyphenyl)-9-methyl-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-methyl-N-phenylacetamide
2-{[2-(4-methoxyphenyl)-9-methyl-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-methyl-N-phenylacetamide
Compound characteristics
| Compound ID: | C683-0865 |
| Compound Name: | 2-{[2-(4-methoxyphenyl)-9-methyl-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-methyl-N-phenylacetamide |
| Molecular Weight: | 483.59 |
| Molecular Formula: | C28 H25 N3 O3 S |
| Smiles: | Cc1cccc2Cc3c(nc(c4ccc(cc4)OC)nc3SCC(N(C)c3ccccc3)=O)Oc12 |
| Stereo: | ACHIRAL |
| logP: | 6.5475 |
| logD: | 6.5444 |
| logSw: | -5.8313 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.472 |
| InChI Key: | CKYUVJRUGCBXCQ-UHFFFAOYSA-N |