N-{2-[2-(3,4-dimethoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6-yl]ethyl}-4-fluoro-3-(trifluoromethyl)benzene-1-sulfonamide
Chemical Structure Depiction of
N-{2-[2-(3,4-dimethoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6-yl]ethyl}-4-fluoro-3-(trifluoromethyl)benzene-1-sulfonamide
N-{2-[2-(3,4-dimethoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6-yl]ethyl}-4-fluoro-3-(trifluoromethyl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | G856-5085 |
| Compound Name: | N-{2-[2-(3,4-dimethoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6-yl]ethyl}-4-fluoro-3-(trifluoromethyl)benzene-1-sulfonamide |
| Molecular Weight: | 530.52 |
| Molecular Formula: | C21 H18 F4 N4 O4 S2 |
| Smiles: | COc1ccc(cc1OC)c1nc2n(c(CCNS(c3ccc(c(c3)C(F)(F)F)F)(=O)=O)cs2)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.5087 |
| logD: | 4.5082 |
| logSw: | -4.4318 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.303 |
| InChI Key: | ZRKNVQWNZHAKGL-UHFFFAOYSA-N |