N-benzyl-4-cyano-N-[3-(2-{[(3-methylphenyl)methyl]amino}-2-oxoethyl)phenyl]benzamide
Chemical Structure Depiction of
N-benzyl-4-cyano-N-[3-(2-{[(3-methylphenyl)methyl]amino}-2-oxoethyl)phenyl]benzamide
N-benzyl-4-cyano-N-[3-(2-{[(3-methylphenyl)methyl]amino}-2-oxoethyl)phenyl]benzamide
Compound characteristics
| Compound ID: | V023-8072 |
| Compound Name: | N-benzyl-4-cyano-N-[3-(2-{[(3-methylphenyl)methyl]amino}-2-oxoethyl)phenyl]benzamide |
| Molecular Weight: | 473.57 |
| Molecular Formula: | C31 H27 N3 O2 |
| Smiles: | Cc1cccc(CNC(Cc2cccc(c2)N(Cc2ccccc2)C(c2ccc(C#N)cc2)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.4823 |
| logD: | 5.4823 |
| logSw: | -5.4476 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.846 |
| InChI Key: | AFDINYYAACAQIH-UHFFFAOYSA-N |