tert-butyl 4-[1-(2,4-dimethylphenyl)-4-{[3-(trifluoromethyl)phenyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-[1-(2,4-dimethylphenyl)-4-{[3-(trifluoromethyl)phenyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate
tert-butyl 4-[1-(2,4-dimethylphenyl)-4-{[3-(trifluoromethyl)phenyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate
Compound characteristics
| Compound ID: | E955-2281 |
| Compound Name: | tert-butyl 4-[1-(2,4-dimethylphenyl)-4-{[3-(trifluoromethyl)phenyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate |
| Molecular Weight: | 542.6 |
| Molecular Formula: | C29 H33 F3 N4 O3 |
| Smiles: | Cc1ccc(c(C)c1)n1c(C2CCN(CC2)C(=O)OC(C)(C)C)c(cn1)C(Nc1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 8.0924 |
| logD: | 8.0831 |
| logSw: | -5.5817 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.933 |
| InChI Key: | SCFPHZXKXQMXOA-UHFFFAOYSA-N |