tert-butyl 4-{1-(3-chloro-2-methylphenyl)-4-[(2,3,5,6-tetrafluorophenyl)carbamoyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-{1-(3-chloro-2-methylphenyl)-4-[(2,3,5,6-tetrafluorophenyl)carbamoyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate
tert-butyl 4-{1-(3-chloro-2-methylphenyl)-4-[(2,3,5,6-tetrafluorophenyl)carbamoyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate
Compound characteristics
| Compound ID: | E955-2250 |
| Compound Name: | tert-butyl 4-{1-(3-chloro-2-methylphenyl)-4-[(2,3,5,6-tetrafluorophenyl)carbamoyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate |
| Molecular Weight: | 566.98 |
| Molecular Formula: | C27 H27 Cl F4 N4 O3 |
| Smiles: | Cc1c(cccc1[Cl])n1c(C2CCN(CC2)C(=O)OC(C)(C)C)c(cn1)C(Nc1c(c(cc(c1F)F)F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 7.0393 |
| logD: | 3.5824 |
| logSw: | -6.3564 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.538 |
| InChI Key: | KKICQKKMERRNTJ-UHFFFAOYSA-N |