3-(phenylmethanesulfonyl)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]propanamide
Chemical Structure Depiction of
3-(phenylmethanesulfonyl)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]propanamide
3-(phenylmethanesulfonyl)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]propanamide
Compound characteristics
| Compound ID: | Y031-1270 |
| Compound Name: | 3-(phenylmethanesulfonyl)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]propanamide |
| Molecular Weight: | 379.38 |
| Molecular Formula: | C13 H12 F3 N3 O3 S2 |
| Smiles: | C(CS(Cc1ccccc1)(=O)=O)C(Nc1nnc(C(F)(F)F)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7679 |
| logD: | -0.8005 |
| logSw: | -2.4015 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.961 |
| InChI Key: | PPCYMYMSRRAXAQ-UHFFFAOYSA-N |