ethyl 3-{2-[(3-cyano-6-phenylpyridin-2-yl)sulfanyl]acetamido}benzoate
Chemical Structure Depiction of
ethyl 3-{2-[(3-cyano-6-phenylpyridin-2-yl)sulfanyl]acetamido}benzoate
ethyl 3-{2-[(3-cyano-6-phenylpyridin-2-yl)sulfanyl]acetamido}benzoate
Compound characteristics
| Compound ID: | D360-0673 |
| Compound Name: | ethyl 3-{2-[(3-cyano-6-phenylpyridin-2-yl)sulfanyl]acetamido}benzoate |
| Molecular Weight: | 417.49 |
| Molecular Formula: | C23 H19 N3 O3 S |
| Smiles: | CCOC(c1cccc(c1)NC(CSc1c(C#N)ccc(c2ccccc2)n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3862 |
| logD: | 5.3862 |
| logSw: | -5.3716 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.402 |
| InChI Key: | ROSBPXFIAGJXMF-UHFFFAOYSA-N |