N-(3,4-dimethoxyphenyl)-1-{[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}piperidine-4-carboxamide
Chemical Structure Depiction of
N-(3,4-dimethoxyphenyl)-1-{[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}piperidine-4-carboxamide
N-(3,4-dimethoxyphenyl)-1-{[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}piperidine-4-carboxamide
Compound characteristics
| Compound ID: | E009-0051 |
| Compound Name: | N-(3,4-dimethoxyphenyl)-1-{[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}piperidine-4-carboxamide |
| Molecular Weight: | 485.59 |
| Molecular Formula: | C28 H31 N5 O3 |
| Smiles: | COc1ccc(cc1OC)NC(C1CCN(CC1)Cc1cnn(c2ccccc2)c1n1cccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7901 |
| logD: | 0.4227 |
| logSw: | -3.7295 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.18 |
| InChI Key: | XDGQLAOUUWDYDY-UHFFFAOYSA-N |