N-[(2,5-dimethylphenyl)methyl]-1-[1-(pyridin-3-yl)-1H-pyrrole-2-carbonyl]piperidine-4-carboxamide
Chemical Structure Depiction of
N-[(2,5-dimethylphenyl)methyl]-1-[1-(pyridin-3-yl)-1H-pyrrole-2-carbonyl]piperidine-4-carboxamide
N-[(2,5-dimethylphenyl)methyl]-1-[1-(pyridin-3-yl)-1H-pyrrole-2-carbonyl]piperidine-4-carboxamide
Compound characteristics
Compound ID: | F234-0408 |
Compound Name: | N-[(2,5-dimethylphenyl)methyl]-1-[1-(pyridin-3-yl)-1H-pyrrole-2-carbonyl]piperidine-4-carboxamide |
Molecular Weight: | 416.52 |
Molecular Formula: | C25 H28 N4 O2 |
Smiles: | Cc1ccc(C)c(CNC(C2CCN(CC2)C(c2cccn2c2cccnc2)=O)=O)c1 |
Stereo: | ACHIRAL |
logP: | 3.6364 |
logD: | 3.6364 |
logSw: | -3.2997 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 52.866 |
InChI Key: | VIOSJNSHZRZIAC-UHFFFAOYSA-N |