3-(4-methoxyphenyl)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]prop-2-enamide
Chemical Structure Depiction of
3-(4-methoxyphenyl)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]prop-2-enamide
3-(4-methoxyphenyl)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]prop-2-enamide
Compound characteristics
| Compound ID: | Y032-2840 |
| Compound Name: | 3-(4-methoxyphenyl)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]prop-2-enamide |
| Molecular Weight: | 329.3 |
| Molecular Formula: | C13 H10 F3 N3 O2 S |
| Smiles: | COc1ccc(/C=C/C(Nc2nnc(C(F)(F)F)s2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.7745 |
| logD: | 1.9693 |
| logSw: | -4.1284 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.205 |
| InChI Key: | NBYCCPQKLDOOTI-UHFFFAOYSA-N |