ethyl 2-[(1,3-benzothiazol-2-yl)amino]-N-(dimethylcarbamoyl)-3,3,3-trifluoroalaninate
Chemical Structure Depiction of
ethyl 2-[(1,3-benzothiazol-2-yl)amino]-N-(dimethylcarbamoyl)-3,3,3-trifluoroalaninate
ethyl 2-[(1,3-benzothiazol-2-yl)amino]-N-(dimethylcarbamoyl)-3,3,3-trifluoroalaninate
Compound characteristics
| Compound ID: | 5256-4238 |
| Compound Name: | ethyl 2-[(1,3-benzothiazol-2-yl)amino]-N-(dimethylcarbamoyl)-3,3,3-trifluoroalaninate |
| Molecular Weight: | 390.38 |
| Molecular Formula: | C15 H17 F3 N4 O3 S |
| Smiles: | CCOC(C(C(F)(F)F)(NC(N(C)C)=O)Nc1nc2ccccc2s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3884 |
| logD: | 3.2746 |
| logSw: | -3.7709 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.772 |
| InChI Key: | NKIOLFUPJBJTGM-AWEZNQCLSA-N |