tert-butyl 4-[1-(3-chloro-2-methylphenyl)-4-{[4-(ethoxycarbonyl)phenyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-[1-(3-chloro-2-methylphenyl)-4-{[4-(ethoxycarbonyl)phenyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate
tert-butyl 4-[1-(3-chloro-2-methylphenyl)-4-{[4-(ethoxycarbonyl)phenyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate
Compound characteristics
| Compound ID: | G612-0632 |
| Compound Name: | tert-butyl 4-[1-(3-chloro-2-methylphenyl)-4-{[4-(ethoxycarbonyl)phenyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate |
| Molecular Weight: | 567.09 |
| Molecular Formula: | C30 H35 Cl N4 O5 |
| Smiles: | CCOC(c1ccc(cc1)NC(c1cnn(c2cccc(c2C)[Cl])c1C1CCN(CC1)C(=O)OC(C)(C)C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 7.5828 |
| logD: | 7.581 |
| logSw: | -6.2717 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.687 |
| InChI Key: | XGMQAAXFSXYNPL-UHFFFAOYSA-N |