N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-N~2~-[4-(trifluoromethyl)benzoyl]isoleucinamide
Chemical Structure Depiction of
N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-N~2~-[4-(trifluoromethyl)benzoyl]isoleucinamide
N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-N~2~-[4-(trifluoromethyl)benzoyl]isoleucinamide
Compound characteristics
| Compound ID: | V025-3595 |
| Compound Name: | N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-N~2~-[4-(trifluoromethyl)benzoyl]isoleucinamide |
| Molecular Weight: | 541.39 |
| Molecular Formula: | C22 H20 Br F3 N4 O2 S |
| Salt: | not_available |
| Smiles: | CCC(C)C(C(Nc1nnc(c2ccc(cc2)[Br])s1)=O)NC(c1ccc(cc1)C(F)(F)F)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.5705 |
| logD: | 6.5702 |
| logSw: | -5.7229 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.64 |
| InChI Key: | HMYTZGQAUXRCIR-UHFFFAOYSA-N |