N-{5-chloro-4-[(4-chlorophenyl)(cyano)methyl]-2-methylphenyl}-3-(phenylmethanesulfonyl)propanamide
Chemical Structure Depiction of
N-{5-chloro-4-[(4-chlorophenyl)(cyano)methyl]-2-methylphenyl}-3-(phenylmethanesulfonyl)propanamide
N-{5-chloro-4-[(4-chlorophenyl)(cyano)methyl]-2-methylphenyl}-3-(phenylmethanesulfonyl)propanamide
Compound characteristics
| Compound ID: | Y032-3848 |
| Compound Name: | N-{5-chloro-4-[(4-chlorophenyl)(cyano)methyl]-2-methylphenyl}-3-(phenylmethanesulfonyl)propanamide |
| Molecular Weight: | 501.43 |
| Molecular Formula: | C25 H22 Cl2 N2 O3 S |
| Smiles: | Cc1cc(C(C#N)c2ccc(cc2)[Cl])c(cc1NC(CCS(Cc1ccccc1)(=O)=O)=O)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4736 |
| logD: | 4.4723 |
| logSw: | -4.765 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.503 |
| InChI Key: | MADFWSGOEIYIOM-QFIPXVFZSA-N |