N~2~-[(3-chloro-4-methylphenyl)carbamoyl]-N-(5-phenyl-1,3,4-thiadiazol-2-yl)isoleucinamide
Chemical Structure Depiction of
N~2~-[(3-chloro-4-methylphenyl)carbamoyl]-N-(5-phenyl-1,3,4-thiadiazol-2-yl)isoleucinamide
N~2~-[(3-chloro-4-methylphenyl)carbamoyl]-N-(5-phenyl-1,3,4-thiadiazol-2-yl)isoleucinamide
Compound characteristics
| Compound ID: | V027-8955 |
| Compound Name: | N~2~-[(3-chloro-4-methylphenyl)carbamoyl]-N-(5-phenyl-1,3,4-thiadiazol-2-yl)isoleucinamide |
| Molecular Weight: | 457.98 |
| Molecular Formula: | C22 H24 Cl N5 O2 S |
| Smiles: | CCC(C)C(C(Nc1nnc(c2ccccc2)s1)=O)NC(Nc1ccc(C)c(c1)[Cl])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.2575 |
| logD: | 6.2573 |
| logSw: | -6.077 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 79.852 |
| InChI Key: | LBVXPMXXROJFDR-UHFFFAOYSA-N |