tert-butyl 4-[1-(3-chloro-4-methylphenyl)-4-(ethoxycarbonyl)-1H-pyrazol-5-yl]piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-[1-(3-chloro-4-methylphenyl)-4-(ethoxycarbonyl)-1H-pyrazol-5-yl]piperidine-1-carboxylate
tert-butyl 4-[1-(3-chloro-4-methylphenyl)-4-(ethoxycarbonyl)-1H-pyrazol-5-yl]piperidine-1-carboxylate
Compound characteristics
| Compound ID: | C614-5214 |
| Compound Name: | tert-butyl 4-[1-(3-chloro-4-methylphenyl)-4-(ethoxycarbonyl)-1H-pyrazol-5-yl]piperidine-1-carboxylate |
| Molecular Weight: | 447.96 |
| Molecular Formula: | C23 H30 Cl N3 O4 |
| Smiles: | CCOC(c1cnn(c2ccc(C)c(c2)[Cl])c1C1CCN(CC1)C(=O)OC(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 6.7309 |
| logD: | 6.7309 |
| logSw: | -6.4081 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.897 |
| InChI Key: | BVFPTYVCTRLKAA-UHFFFAOYSA-N |