methyl 2-[(1,3-benzothiazol-2-yl)amino]-3,3,3-trifluoro-N-(4-methylbenzoyl)alaninate
Chemical Structure Depiction of
methyl 2-[(1,3-benzothiazol-2-yl)amino]-3,3,3-trifluoro-N-(4-methylbenzoyl)alaninate
methyl 2-[(1,3-benzothiazol-2-yl)amino]-3,3,3-trifluoro-N-(4-methylbenzoyl)alaninate
Compound characteristics
| Compound ID: | 8012-2924 |
| Compound Name: | methyl 2-[(1,3-benzothiazol-2-yl)amino]-3,3,3-trifluoro-N-(4-methylbenzoyl)alaninate |
| Molecular Weight: | 423.41 |
| Molecular Formula: | C19 H16 F3 N3 O3 S |
| Smiles: | Cc1ccc(cc1)C(NC(C(=O)OC)(C(F)(F)F)Nc1nc2ccccc2s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9453 |
| logD: | 3.4341 |
| logSw: | -4.7009 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.462 |
| InChI Key: | HXMLKZZERUWFBL-GOSISDBHSA-N |