N-butyl-N-[3-oxo-3-({5-[4-(trifluoromethyl)phenyl]-1,3,4-thiadiazol-2-yl}amino)propyl]-3-(trifluoromethyl)benzamide
Chemical Structure Depiction of
N-butyl-N-[3-oxo-3-({5-[4-(trifluoromethyl)phenyl]-1,3,4-thiadiazol-2-yl}amino)propyl]-3-(trifluoromethyl)benzamide
N-butyl-N-[3-oxo-3-({5-[4-(trifluoromethyl)phenyl]-1,3,4-thiadiazol-2-yl}amino)propyl]-3-(trifluoromethyl)benzamide
Compound characteristics
| Compound ID: | V025-9881 |
| Compound Name: | N-butyl-N-[3-oxo-3-({5-[4-(trifluoromethyl)phenyl]-1,3,4-thiadiazol-2-yl}amino)propyl]-3-(trifluoromethyl)benzamide |
| Molecular Weight: | 544.52 |
| Molecular Formula: | C24 H22 F6 N4 O2 S |
| Salt: | not_available |
| Smiles: | CCCCN(CCC(Nc1nnc(c2ccc(cc2)C(F)(F)F)s1)=O)C(c1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8888 |
| logD: | 5.8885 |
| logSw: | -5.5426 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.829 |
| InChI Key: | MKRBWXQBUDILFZ-UHFFFAOYSA-N |