tert-butyl 4-[1-(3-chloro-2-methylphenyl)-4-{[(4-methylphenyl)methyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-[1-(3-chloro-2-methylphenyl)-4-{[(4-methylphenyl)methyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate
tert-butyl 4-[1-(3-chloro-2-methylphenyl)-4-{[(4-methylphenyl)methyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate
Compound characteristics
| Compound ID: | E955-2171 |
| Compound Name: | tert-butyl 4-[1-(3-chloro-2-methylphenyl)-4-{[(4-methylphenyl)methyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate |
| Molecular Weight: | 523.08 |
| Molecular Formula: | C29 H35 Cl N4 O3 |
| Smiles: | Cc1ccc(CNC(c2cnn(c3cccc(c3C)[Cl])c2C2CCN(CC2)C(=O)OC(C)(C)C)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 7.3685 |
| logD: | 7.3685 |
| logSw: | -6.2604 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.256 |
| InChI Key: | AARVXMGJSCHBOU-UHFFFAOYSA-N |