N-[5-({[2-(trifluoromethyl)phenyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]cyclohexanecarboxamide
Chemical Structure Depiction of
N-[5-({[2-(trifluoromethyl)phenyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]cyclohexanecarboxamide
N-[5-({[2-(trifluoromethyl)phenyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]cyclohexanecarboxamide
Compound characteristics
| Compound ID: | V004-3507 |
| Compound Name: | N-[5-({[2-(trifluoromethyl)phenyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]cyclohexanecarboxamide |
| Molecular Weight: | 401.47 |
| Molecular Formula: | C17 H18 F3 N3 O S2 |
| Smiles: | C1CCC(CC1)C(Nc1nnc(SCc2ccccc2C(F)(F)F)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.59 |
| logD: | 5.5836 |
| logSw: | -5.6153 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.156 |
| InChI Key: | RHOGOKLCHVFCGV-UHFFFAOYSA-N |