2-{[2-(4-ethoxyphenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N,N-diethylacetamide
Chemical Structure Depiction of
2-{[2-(4-ethoxyphenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N,N-diethylacetamide
2-{[2-(4-ethoxyphenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N,N-diethylacetamide
Compound characteristics
| Compound ID: | C683-0389 |
| Compound Name: | 2-{[2-(4-ethoxyphenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N,N-diethylacetamide |
| Molecular Weight: | 449.57 |
| Molecular Formula: | C25 H27 N3 O3 S |
| Smiles: | CCN(CC)C(CSc1c2Cc3ccccc3Oc2nc(c2ccc(cc2)OCC)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1837 |
| logD: | 6.1806 |
| logSw: | -5.6918 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.931 |
| InChI Key: | MTBQVUYPCDRPOT-UHFFFAOYSA-N |