2-{[2-(4-ethoxyphenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-(2-methylphenyl)acetamide
Chemical Structure Depiction of
2-{[2-(4-ethoxyphenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-(2-methylphenyl)acetamide
2-{[2-(4-ethoxyphenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-(2-methylphenyl)acetamide
Compound characteristics
Compound ID: | C683-0379 |
Compound Name: | 2-{[2-(4-ethoxyphenyl)-5H-[1]benzopyrano[2,3-d]pyrimidin-4-yl]sulfanyl}-N-(2-methylphenyl)acetamide |
Molecular Weight: | 483.59 |
Molecular Formula: | C28 H25 N3 O3 S |
Smiles: | CCOc1ccc(cc1)c1nc2c(Cc3ccccc3O2)c(n1)SCC(Nc1ccccc1C)=O |
Stereo: | ACHIRAL |
logP: | 6.8351 |
logD: | 6.8321 |
logSw: | -5.7735 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 55.706 |
InChI Key: | NYIUGQHRXNHMLW-UHFFFAOYSA-N |