1-{[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}-N-({4-[(propan-2-yl)oxy]phenyl}methyl)piperidine-4-carboxamide
Chemical Structure Depiction of
1-{[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}-N-({4-[(propan-2-yl)oxy]phenyl}methyl)piperidine-4-carboxamide
1-{[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}-N-({4-[(propan-2-yl)oxy]phenyl}methyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | E009-0194 |
| Compound Name: | 1-{[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}-N-({4-[(propan-2-yl)oxy]phenyl}methyl)piperidine-4-carboxamide |
| Molecular Weight: | 497.64 |
| Molecular Formula: | C30 H35 N5 O2 |
| Smiles: | CC(C)Oc1ccc(CNC(C2CCN(CC2)Cc2cnn(c3ccccc3)c2n2cccc2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.6106 |
| logD: | 1.1271 |
| logSw: | -3.9972 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.044 |
| InChI Key: | SSJQPUCRMSCABD-UHFFFAOYSA-N |