3,5,5-trimethyl-N-[5-({[4-(trifluoromethyl)phenyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]hexanamide
Chemical Structure Depiction of
3,5,5-trimethyl-N-[5-({[4-(trifluoromethyl)phenyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]hexanamide
3,5,5-trimethyl-N-[5-({[4-(trifluoromethyl)phenyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]hexanamide
Compound characteristics
| Compound ID: | V002-1339 |
| Compound Name: | 3,5,5-trimethyl-N-[5-({[4-(trifluoromethyl)phenyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]hexanamide |
| Molecular Weight: | 431.54 |
| Molecular Formula: | C19 H24 F3 N3 O S2 |
| Smiles: | CC(CC(Nc1nnc(SCc2ccc(cc2)C(F)(F)F)s1)=O)CC(C)(C)C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.2544 |
| logD: | 6.2508 |
| logSw: | -5.5217 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.022 |
| InChI Key: | HLGXTINHPDAUBB-GFCCVEGCSA-N |