ethyl N-(6-chloro-1,3-benzothiazol-2-yl)-2-[(ethoxycarbonyl)amino]-3,3,3-trifluoroalaninate
Chemical Structure Depiction of
ethyl N-(6-chloro-1,3-benzothiazol-2-yl)-2-[(ethoxycarbonyl)amino]-3,3,3-trifluoroalaninate
ethyl N-(6-chloro-1,3-benzothiazol-2-yl)-2-[(ethoxycarbonyl)amino]-3,3,3-trifluoroalaninate
Compound characteristics
| Compound ID: | 8012-8642 |
| Compound Name: | ethyl N-(6-chloro-1,3-benzothiazol-2-yl)-2-[(ethoxycarbonyl)amino]-3,3,3-trifluoroalaninate |
| Molecular Weight: | 425.81 |
| Molecular Formula: | C15 H15 Cl F3 N3 O4 S |
| Smiles: | CCOC(C(C(F)(F)F)(NC(=O)OCC)Nc1nc2ccc(cc2s1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8006 |
| logD: | 4.0118 |
| logSw: | -4.7619 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.394 |
| InChI Key: | GOHSCHJDSHZJFA-AWEZNQCLSA-N |