4-[4-(2,4-dimethylphenyl)piperazin-1-yl]-4-oxo-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide
Chemical Structure Depiction of
4-[4-(2,4-dimethylphenyl)piperazin-1-yl]-4-oxo-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide
4-[4-(2,4-dimethylphenyl)piperazin-1-yl]-4-oxo-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide
Compound characteristics
| Compound ID: | D216-2040 |
| Compound Name: | 4-[4-(2,4-dimethylphenyl)piperazin-1-yl]-4-oxo-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide |
| Molecular Weight: | 441.47 |
| Molecular Formula: | C19 H22 F3 N5 O2 S |
| Smiles: | Cc1ccc(c(C)c1)N1CCN(CC1)C(CCC(Nc1nnc(C(F)(F)F)s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5003 |
| logD: | 1.4772 |
| logSw: | -3.8613 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.013 |
| InChI Key: | IBKRJUMGTWNYEA-UHFFFAOYSA-N |