ethyl 1-{1-[(4-methylphenyl)methyl]-4-(pyridin-4-yl)-1H-pyrrole-2-carbonyl}piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-{1-[(4-methylphenyl)methyl]-4-(pyridin-4-yl)-1H-pyrrole-2-carbonyl}piperidine-4-carboxylate
ethyl 1-{1-[(4-methylphenyl)methyl]-4-(pyridin-4-yl)-1H-pyrrole-2-carbonyl}piperidine-4-carboxylate
Compound characteristics
| Compound ID: | P076-0764 |
| Compound Name: | ethyl 1-{1-[(4-methylphenyl)methyl]-4-(pyridin-4-yl)-1H-pyrrole-2-carbonyl}piperidine-4-carboxylate |
| Molecular Weight: | 431.53 |
| Molecular Formula: | C26 H29 N3 O3 |
| Smiles: | CCOC(C1CCN(CC1)C(c1cc(cn1Cc1ccc(C)cc1)c1ccncc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0236 |
| logD: | 4.0187 |
| logSw: | -3.7462 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.28 |
| InChI Key: | XVOXJMWBQAKFIZ-UHFFFAOYSA-N |