N-(2-chloro-4-methylphenyl)-1-{[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}piperidine-4-carboxamide
Chemical Structure Depiction of
N-(2-chloro-4-methylphenyl)-1-{[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}piperidine-4-carboxamide
N-(2-chloro-4-methylphenyl)-1-{[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}piperidine-4-carboxamide
Compound characteristics
| Compound ID: | E009-0102 |
| Compound Name: | N-(2-chloro-4-methylphenyl)-1-{[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}piperidine-4-carboxamide |
| Molecular Weight: | 474.01 |
| Molecular Formula: | C27 H28 Cl N5 O |
| Smiles: | Cc1ccc(c(c1)[Cl])NC(C1CCN(CC1)Cc1cnn(c2ccccc2)c1n1cccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2776 |
| logD: | 1.9102 |
| logSw: | -5.8217 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.221 |
| InChI Key: | CMQGNIUHXRYDSX-UHFFFAOYSA-N |