ethyl 4-(2-{[2-(pyridin-2-yl)ethyl]sulfanyl}acetamido)benzoate
Chemical Structure Depiction of
ethyl 4-(2-{[2-(pyridin-2-yl)ethyl]sulfanyl}acetamido)benzoate
ethyl 4-(2-{[2-(pyridin-2-yl)ethyl]sulfanyl}acetamido)benzoate
Compound characteristics
| Compound ID: | C700-0367 |
| Compound Name: | ethyl 4-(2-{[2-(pyridin-2-yl)ethyl]sulfanyl}acetamido)benzoate |
| Molecular Weight: | 344.43 |
| Molecular Formula: | C18 H20 N2 O3 S |
| Smiles: | CCOC(c1ccc(cc1)NC(CSCCc1ccccn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4776 |
| logD: | 3.4769 |
| logSw: | -3.6818 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.413 |
| InChI Key: | KYQMIPJIVYDYIF-UHFFFAOYSA-N |