N-{5-chloro-4-[(4-chlorophenyl)(cyano)methyl]-2-methylphenyl}-3,3-dimethylbutanamide
Chemical Structure Depiction of
N-{5-chloro-4-[(4-chlorophenyl)(cyano)methyl]-2-methylphenyl}-3,3-dimethylbutanamide
N-{5-chloro-4-[(4-chlorophenyl)(cyano)methyl]-2-methylphenyl}-3,3-dimethylbutanamide
Compound characteristics
| Compound ID: | Y031-0581 |
| Compound Name: | N-{5-chloro-4-[(4-chlorophenyl)(cyano)methyl]-2-methylphenyl}-3,3-dimethylbutanamide |
| Molecular Weight: | 389.32 |
| Molecular Formula: | C21 H22 Cl2 N2 O |
| Smiles: | Cc1cc(C(C#N)c2ccc(cc2)[Cl])c(cc1NC(CC(C)(C)C)=O)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8742 |
| logD: | 5.8735 |
| logSw: | -6.21 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.475 |
| InChI Key: | POBGAEZFYPKFMI-KRWDZBQOSA-N |