tert-butyl 4-{4-[(4-chloro-2-methoxy-5-methylphenyl)carbamoyl]-1-(3,4-dimethylphenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-{4-[(4-chloro-2-methoxy-5-methylphenyl)carbamoyl]-1-(3,4-dimethylphenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate
tert-butyl 4-{4-[(4-chloro-2-methoxy-5-methylphenyl)carbamoyl]-1-(3,4-dimethylphenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate
Compound characteristics
| Compound ID: | E955-0376 |
| Compound Name: | tert-butyl 4-{4-[(4-chloro-2-methoxy-5-methylphenyl)carbamoyl]-1-(3,4-dimethylphenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate |
| Molecular Weight: | 553.1 |
| Molecular Formula: | C30 H37 Cl N4 O4 |
| Smiles: | Cc1ccc(cc1C)n1c(C2CCN(CC2)C(=O)OC(C)(C)C)c(cn1)C(Nc1cc(C)c(cc1OC)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 8.2259 |
| logD: | 8.1853 |
| logSw: | -6.5739 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.167 |
| InChI Key: | HHUMIKPRWIURCG-UHFFFAOYSA-N |