N-(2-ethoxyphenyl)-4,6-dimethyl-2-{[2-oxo-2-(2-oxo-2H-1-benzopyran-3-yl)ethyl]sulfanyl}pyridine-3-carboxamide
Chemical Structure Depiction of
N-(2-ethoxyphenyl)-4,6-dimethyl-2-{[2-oxo-2-(2-oxo-2H-1-benzopyran-3-yl)ethyl]sulfanyl}pyridine-3-carboxamide
N-(2-ethoxyphenyl)-4,6-dimethyl-2-{[2-oxo-2-(2-oxo-2H-1-benzopyran-3-yl)ethyl]sulfanyl}pyridine-3-carboxamide
Compound characteristics
| Compound ID: | D276-0732 |
| Compound Name: | N-(2-ethoxyphenyl)-4,6-dimethyl-2-{[2-oxo-2-(2-oxo-2H-1-benzopyran-3-yl)ethyl]sulfanyl}pyridine-3-carboxamide |
| Molecular Weight: | 488.56 |
| Molecular Formula: | C27 H24 N2 O5 S |
| Smiles: | CCOc1ccccc1NC(c1c(C)cc(C)nc1SCC(C1=Cc2ccccc2OC1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9288 |
| logD: | 4.9103 |
| logSw: | -4.783 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.293 |
| InChI Key: | WJZVFUFOZGYUPF-UHFFFAOYSA-N |