tert-butyl 4-{4-[4-(2,4-dimethylphenyl)piperazine-1-carbonyl]-1-(4-fluorophenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-{4-[4-(2,4-dimethylphenyl)piperazine-1-carbonyl]-1-(4-fluorophenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate
tert-butyl 4-{4-[4-(2,4-dimethylphenyl)piperazine-1-carbonyl]-1-(4-fluorophenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate
Compound characteristics
| Compound ID: | E955-1752 |
| Compound Name: | tert-butyl 4-{4-[4-(2,4-dimethylphenyl)piperazine-1-carbonyl]-1-(4-fluorophenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate |
| Molecular Weight: | 561.7 |
| Molecular Formula: | C32 H40 F N5 O3 |
| Smiles: | Cc1ccc(c(C)c1)N1CCN(CC1)C(c1cnn(c2ccc(cc2)F)c1C1CCN(CC1)C(=O)OC(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 7.1738 |
| logD: | 7.1737 |
| logSw: | -5.4986 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 54.751 |
| InChI Key: | LVVKCUFGUAVWDI-UHFFFAOYSA-N |