N~2~-(4-bromobenzoyl)-N-(5-phenyl-1,3,4-thiadiazol-2-yl)isoleucinamide
Chemical Structure Depiction of
N~2~-(4-bromobenzoyl)-N-(5-phenyl-1,3,4-thiadiazol-2-yl)isoleucinamide
N~2~-(4-bromobenzoyl)-N-(5-phenyl-1,3,4-thiadiazol-2-yl)isoleucinamide
Compound characteristics
| Compound ID: | V016-3917 |
| Compound Name: | N~2~-(4-bromobenzoyl)-N-(5-phenyl-1,3,4-thiadiazol-2-yl)isoleucinamide |
| Molecular Weight: | 473.39 |
| Molecular Formula: | C21 H21 Br N4 O2 S |
| Salt: | not_available |
| Smiles: | CCC(C)C(C(Nc1nnc(c2ccccc2)s1)=O)NC(c1ccc(cc1)[Br])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.5927 |
| logD: | 5.5924 |
| logSw: | -5.513 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.64 |
| InChI Key: | ZZQVCSNEHAXUSC-UHFFFAOYSA-N |