tert-butyl 4-[1-(2,4-dimethylphenyl)-4-{[(4-fluorophenyl)methyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-[1-(2,4-dimethylphenyl)-4-{[(4-fluorophenyl)methyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate
tert-butyl 4-[1-(2,4-dimethylphenyl)-4-{[(4-fluorophenyl)methyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate
Compound characteristics
| Compound ID: | E955-2339 |
| Compound Name: | tert-butyl 4-[1-(2,4-dimethylphenyl)-4-{[(4-fluorophenyl)methyl]carbamoyl}-1H-pyrazol-5-yl]piperidine-1-carboxylate |
| Molecular Weight: | 506.62 |
| Molecular Formula: | C29 H35 F N4 O3 |
| Smiles: | Cc1ccc(c(C)c1)n1c(C2CCN(CC2)C(=O)OC(C)(C)C)c(cn1)C(NCc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 7.0419 |
| logD: | 7.0419 |
| logSw: | -5.49 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.256 |
| InChI Key: | IVEZQQZKXZMHIG-UHFFFAOYSA-N |