N-{5-chloro-4-[(4-chlorophenyl)(cyano)methyl]-2-methylphenyl}-1-(2,5-dimethoxybenzene-1-sulfonyl)prolinamide
Chemical Structure Depiction of
N-{5-chloro-4-[(4-chlorophenyl)(cyano)methyl]-2-methylphenyl}-1-(2,5-dimethoxybenzene-1-sulfonyl)prolinamide
N-{5-chloro-4-[(4-chlorophenyl)(cyano)methyl]-2-methylphenyl}-1-(2,5-dimethoxybenzene-1-sulfonyl)prolinamide
Compound characteristics
| Compound ID: | 8019-8834 |
| Compound Name: | N-{5-chloro-4-[(4-chlorophenyl)(cyano)methyl]-2-methylphenyl}-1-(2,5-dimethoxybenzene-1-sulfonyl)prolinamide |
| Molecular Weight: | 588.51 |
| Molecular Formula: | C28 H27 Cl2 N3 O5 S |
| Smiles: | Cc1cc(C(C#N)c2ccc(cc2)[Cl])c(cc1NC(C1CCCN1S(c1cc(ccc1OC)OC)(=O)=O)=O)[Cl] |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.3688 |
| logD: | 5.3645 |
| logSw: | -6.1011 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.138 |
| InChI Key: | IRYSAPZKDFWDTM-UHFFFAOYSA-N |