3-{1-[4-(cyanomethyl)phenyl]-5-(2,4-dimethylphenyl)-1H-pyrrol-2-yl}-N-cyclobutylpropanamide
Chemical Structure Depiction of
3-{1-[4-(cyanomethyl)phenyl]-5-(2,4-dimethylphenyl)-1H-pyrrol-2-yl}-N-cyclobutylpropanamide
3-{1-[4-(cyanomethyl)phenyl]-5-(2,4-dimethylphenyl)-1H-pyrrol-2-yl}-N-cyclobutylpropanamide
Compound characteristics
| Compound ID: | V009-6798 |
| Compound Name: | 3-{1-[4-(cyanomethyl)phenyl]-5-(2,4-dimethylphenyl)-1H-pyrrol-2-yl}-N-cyclobutylpropanamide |
| Molecular Weight: | 411.55 |
| Molecular Formula: | C27 H29 N3 O |
| Smiles: | Cc1ccc(c(C)c1)c1ccc(CCC(NC2CCC2)=O)n1c1ccc(CC#N)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.8371 |
| logD: | 4.8371 |
| logSw: | -4.4885 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.144 |
| InChI Key: | OKAARTFHJRAJCT-UHFFFAOYSA-N |