N-[5-({2-oxo-2-[3-(trifluoromethyl)phenyl]ethyl}sulfanyl)-1,3,4-thiadiazol-2-yl]heptanamide
Chemical Structure Depiction of
N-[5-({2-oxo-2-[3-(trifluoromethyl)phenyl]ethyl}sulfanyl)-1,3,4-thiadiazol-2-yl]heptanamide
N-[5-({2-oxo-2-[3-(trifluoromethyl)phenyl]ethyl}sulfanyl)-1,3,4-thiadiazol-2-yl]heptanamide
Compound characteristics
| Compound ID: | V013-5075 |
| Compound Name: | N-[5-({2-oxo-2-[3-(trifluoromethyl)phenyl]ethyl}sulfanyl)-1,3,4-thiadiazol-2-yl]heptanamide |
| Molecular Weight: | 431.5 |
| Molecular Formula: | C18 H20 F3 N3 O2 S2 |
| Smiles: | CCCCCCC(Nc1nnc(SCC(c2cccc(c2)C(F)(F)F)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6926 |
| logD: | 5.6903 |
| logSw: | -5.3349 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.269 |
| InChI Key: | RQJUGRHYEZYURU-UHFFFAOYSA-N |