N~3~-(benzenesulfonyl)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-beta-alaninamide
Chemical Structure Depiction of
N~3~-(benzenesulfonyl)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-beta-alaninamide
N~3~-(benzenesulfonyl)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-beta-alaninamide
Compound characteristics
| Compound ID: | Y032-4477 |
| Compound Name: | N~3~-(benzenesulfonyl)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-beta-alaninamide |
| Molecular Weight: | 380.36 |
| Molecular Formula: | C12 H11 F3 N4 O3 S2 |
| Smiles: | C(CNS(c1ccccc1)(=O)=O)C(Nc1nnc(C(F)(F)F)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2496 |
| logD: | -0.3189 |
| logSw: | -2.9646 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.533 |
| InChI Key: | CLMPCFBHLDDCMD-UHFFFAOYSA-N |