N-[5-(3-bromophenyl)-1,3,4-thiadiazol-2-yl]-N~2~-[(3-chlorophenyl)carbamoyl]isoleucinamide
Chemical Structure Depiction of
N-[5-(3-bromophenyl)-1,3,4-thiadiazol-2-yl]-N~2~-[(3-chlorophenyl)carbamoyl]isoleucinamide
N-[5-(3-bromophenyl)-1,3,4-thiadiazol-2-yl]-N~2~-[(3-chlorophenyl)carbamoyl]isoleucinamide
Compound characteristics
| Compound ID: | V025-3591 |
| Compound Name: | N-[5-(3-bromophenyl)-1,3,4-thiadiazol-2-yl]-N~2~-[(3-chlorophenyl)carbamoyl]isoleucinamide |
| Molecular Weight: | 522.85 |
| Molecular Formula: | C21 H21 Br Cl N5 O2 S |
| Salt: | not_available |
| Smiles: | CCC(C)C(C(Nc1nnc(c2cccc(c2)[Br])s1)=O)NC(Nc1cccc(c1)[Cl])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.5556 |
| logD: | 6.5554 |
| logSw: | -6.31 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 79.852 |
| InChI Key: | LYKVSXXVGWAIJS-UHFFFAOYSA-N |