ethyl (2-{2-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]acetamido}-1,3-thiazol-4-yl)acetate
Chemical Structure Depiction of
ethyl (2-{2-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]acetamido}-1,3-thiazol-4-yl)acetate
ethyl (2-{2-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]acetamido}-1,3-thiazol-4-yl)acetate
Compound characteristics
| Compound ID: | 5518-2017 |
| Compound Name: | ethyl (2-{2-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]acetamido}-1,3-thiazol-4-yl)acetate |
| Molecular Weight: | 416.52 |
| Molecular Formula: | C19 H20 N4 O3 S2 |
| Smiles: | CCOC(Cc1csc(NC(CSc2c(C#N)cc3CCCCc3n2)=O)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7142 |
| logD: | 3.7121 |
| logSw: | -3.7912 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.041 |
| InChI Key: | NBNZMQZFKLHQPI-UHFFFAOYSA-N |