N~2~-[(4-bromophenyl)carbamoyl]-N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]isoleucinamide
Chemical Structure Depiction of
N~2~-[(4-bromophenyl)carbamoyl]-N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]isoleucinamide
N~2~-[(4-bromophenyl)carbamoyl]-N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]isoleucinamide
Compound characteristics
| Compound ID: | V017-4938 |
| Compound Name: | N~2~-[(4-bromophenyl)carbamoyl]-N-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]isoleucinamide |
| Molecular Weight: | 506.4 |
| Molecular Formula: | C21 H21 Br F N5 O2 S |
| Smiles: | CCC(C)C(C(Nc1nnc(c2ccc(cc2)F)s1)=O)NC(Nc1ccc(cc1)[Br])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.8354 |
| logD: | 5.8351 |
| logSw: | -5.4963 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 79.852 |
| InChI Key: | XJXHQUUAEBAAJR-UHFFFAOYSA-N |