N-benzyl-3-{1-[4-(cyanomethyl)phenyl]-5-(2,4-dimethylphenyl)-1H-pyrrol-2-yl}-N-ethylpropanamide
Chemical Structure Depiction of
N-benzyl-3-{1-[4-(cyanomethyl)phenyl]-5-(2,4-dimethylphenyl)-1H-pyrrol-2-yl}-N-ethylpropanamide
N-benzyl-3-{1-[4-(cyanomethyl)phenyl]-5-(2,4-dimethylphenyl)-1H-pyrrol-2-yl}-N-ethylpropanamide
Compound characteristics
| Compound ID: | V007-7022 |
| Compound Name: | N-benzyl-3-{1-[4-(cyanomethyl)phenyl]-5-(2,4-dimethylphenyl)-1H-pyrrol-2-yl}-N-ethylpropanamide |
| Molecular Weight: | 475.63 |
| Molecular Formula: | C32 H33 N3 O |
| Smiles: | CCN(Cc1ccccc1)C(CCc1ccc(c2ccc(C)cc2C)n1c1ccc(CC#N)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1848 |
| logD: | 6.1848 |
| logSw: | -5.4466 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 34.296 |
| InChI Key: | YIVHHAAVXOKLEN-UHFFFAOYSA-N |