tert-butyl 4-{4-[(4-chloro-2-methoxy-5-methylphenyl)carbamoyl]-1-(4-fluorophenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-{4-[(4-chloro-2-methoxy-5-methylphenyl)carbamoyl]-1-(4-fluorophenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate
tert-butyl 4-{4-[(4-chloro-2-methoxy-5-methylphenyl)carbamoyl]-1-(4-fluorophenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate
Compound characteristics
| Compound ID: | E955-1796 |
| Compound Name: | tert-butyl 4-{4-[(4-chloro-2-methoxy-5-methylphenyl)carbamoyl]-1-(4-fluorophenyl)-1H-pyrazol-5-yl}piperidine-1-carboxylate |
| Molecular Weight: | 543.04 |
| Molecular Formula: | C28 H32 Cl F N4 O4 |
| Smiles: | Cc1cc(c(cc1[Cl])OC)NC(c1cnn(c2ccc(cc2)F)c1C1CCN(CC1)C(=O)OC(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 7.1274 |
| logD: | 7.0869 |
| logSw: | -6.4502 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.167 |
| InChI Key: | GKXCCTIEKLGEAY-UHFFFAOYSA-N |