N-{5-chloro-4-[(4-chlorophenyl)(cyano)methyl]-2-methylphenyl}-2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetamide
Chemical Structure Depiction of
N-{5-chloro-4-[(4-chlorophenyl)(cyano)methyl]-2-methylphenyl}-2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetamide
N-{5-chloro-4-[(4-chlorophenyl)(cyano)methyl]-2-methylphenyl}-2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetamide
Compound characteristics
| Compound ID: | Y031-0602 |
| Compound Name: | N-{5-chloro-4-[(4-chlorophenyl)(cyano)methyl]-2-methylphenyl}-2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetamide |
| Molecular Weight: | 478.33 |
| Molecular Formula: | C25 H17 Cl2 N3 O3 |
| Smiles: | Cc1cc(C(C#N)c2ccc(cc2)[Cl])c(cc1NC(CN1C(c2ccccc2C1=O)=O)=O)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9079 |
| logD: | 4.9078 |
| logSw: | -4.9926 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.728 |
| InChI Key: | PIDCYYJQDVRPSK-FQEVSTJZSA-N |