2-(trifluoromethyl)-1,3-benzothiazole-6-carboxylic acid
Chemical Structure Depiction of
2-(trifluoromethyl)-1,3-benzothiazole-6-carboxylic acid
2-(trifluoromethyl)-1,3-benzothiazole-6-carboxylic acid
Compound characteristics
| Compound ID: | Y042-7673 |
| Compound Name: | 2-(trifluoromethyl)-1,3-benzothiazole-6-carboxylic acid |
| Molecular Weight: | 247.19 |
| Molecular Formula: | C9 H4 F3 N O2 S |
| Smiles: | c1cc2c(cc1C(O)=O)sc(C(F)(F)F)n2 |
| Stereo: | ACHIRAL |
| logP: | 3.3274 |
| logD: | 0.8984 |
| logSw: | -3.5778 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.367 |
| InChI Key: | GSINBWGBXZPBCL-UHFFFAOYSA-N |