ethyl (2-{2-[(3-cyano-6-phenylpyridin-2-yl)sulfanyl]acetamido}-1,3-thiazol-4-yl)acetate
Chemical Structure Depiction of
ethyl (2-{2-[(3-cyano-6-phenylpyridin-2-yl)sulfanyl]acetamido}-1,3-thiazol-4-yl)acetate
ethyl (2-{2-[(3-cyano-6-phenylpyridin-2-yl)sulfanyl]acetamido}-1,3-thiazol-4-yl)acetate
Compound characteristics
| Compound ID: | D360-0671 |
| Compound Name: | ethyl (2-{2-[(3-cyano-6-phenylpyridin-2-yl)sulfanyl]acetamido}-1,3-thiazol-4-yl)acetate |
| Molecular Weight: | 438.53 |
| Molecular Formula: | C21 H18 N4 O3 S2 |
| Smiles: | CCOC(Cc1csc(NC(CSc2c(C#N)ccc(c3ccccc3)n2)=O)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4094 |
| logD: | 4.4073 |
| logSw: | -4.2783 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.349 |
| InChI Key: | IWEBIECGFKRFBI-UHFFFAOYSA-N |