tert-butyl 4-{4-[(3-chloro-4-fluorophenyl)carbamoyl]-1-(3-chloro-2-methylphenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-{4-[(3-chloro-4-fluorophenyl)carbamoyl]-1-(3-chloro-2-methylphenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate
tert-butyl 4-{4-[(3-chloro-4-fluorophenyl)carbamoyl]-1-(3-chloro-2-methylphenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate
Compound characteristics
| Compound ID: | E955-2207 |
| Compound Name: | tert-butyl 4-{4-[(3-chloro-4-fluorophenyl)carbamoyl]-1-(3-chloro-2-methylphenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate |
| Molecular Weight: | 547.46 |
| Molecular Formula: | C27 H29 Cl2 F N4 O3 |
| Smiles: | Cc1c(cccc1[Cl])n1c(C2CCN(CC2)C(=O)OC(C)(C)C)c(cn1)C(Nc1ccc(c(c1)[Cl])F)=O |
| Stereo: | ACHIRAL |
| logP: | 7.7116 |
| logD: | 7.5647 |
| logSw: | -6.4167 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.933 |
| InChI Key: | UUSPLOHPDPZYFP-UHFFFAOYSA-N |