3-methyl-N-[5-({[2-(trifluoromethyl)phenyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]butanamide
Chemical Structure Depiction of
3-methyl-N-[5-({[2-(trifluoromethyl)phenyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]butanamide
3-methyl-N-[5-({[2-(trifluoromethyl)phenyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]butanamide
Compound characteristics
| Compound ID: | V010-2948 |
| Compound Name: | 3-methyl-N-[5-({[2-(trifluoromethyl)phenyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]butanamide |
| Molecular Weight: | 375.43 |
| Molecular Formula: | C15 H16 F3 N3 O S2 |
| Smiles: | CC(C)CC(Nc1nnc(SCc2ccccc2C(F)(F)F)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1064 |
| logD: | 5.1028 |
| logSw: | -4.8662 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.022 |
| InChI Key: | JDPPTAAXIMNCFF-UHFFFAOYSA-N |