tert-butyl 4-{1-(3,4-dimethylphenyl)-4-[(3,4,5-trimethoxyphenyl)carbamoyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-{1-(3,4-dimethylphenyl)-4-[(3,4,5-trimethoxyphenyl)carbamoyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate
tert-butyl 4-{1-(3,4-dimethylphenyl)-4-[(3,4,5-trimethoxyphenyl)carbamoyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate
Compound characteristics
| Compound ID: | C614-0851 |
| Compound Name: | tert-butyl 4-{1-(3,4-dimethylphenyl)-4-[(3,4,5-trimethoxyphenyl)carbamoyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate |
| Molecular Weight: | 564.68 |
| Molecular Formula: | C31 H40 N4 O6 |
| Smiles: | Cc1ccc(cc1C)n1c(C2CCN(CC2)C(=O)OC(C)(C)C)c(cn1)C(Nc1cc(c(c(c1)OC)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 6.4573 |
| logD: | 6.4503 |
| logSw: | -5.5203 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.212 |
| InChI Key: | JDKNGELXNAGHLS-UHFFFAOYSA-N |