tert-butyl 4-{4-[(2-chloro-4-methylphenyl)carbamoyl]-1-(2,4-difluorophenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-{4-[(2-chloro-4-methylphenyl)carbamoyl]-1-(2,4-difluorophenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate
tert-butyl 4-{4-[(2-chloro-4-methylphenyl)carbamoyl]-1-(2,4-difluorophenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate
Compound characteristics
| Compound ID: | E955-0763 |
| Compound Name: | tert-butyl 4-{4-[(2-chloro-4-methylphenyl)carbamoyl]-1-(2,4-difluorophenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate |
| Molecular Weight: | 531 |
| Molecular Formula: | C27 H29 Cl F2 N4 O3 |
| Smiles: | Cc1ccc(c(c1)[Cl])NC(c1cnn(c2ccc(cc2F)F)c1C1CCN(CC1)C(=O)OC(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 6.8539 |
| logD: | 6.8501 |
| logSw: | -6.3193 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.236 |
| InChI Key: | IRMMNYXJDQVVNC-UHFFFAOYSA-N |