ethyl 1-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}piperidine-3-carboxylate
Chemical Structure Depiction of
ethyl 1-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}piperidine-3-carboxylate
ethyl 1-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}piperidine-3-carboxylate
Compound characteristics
| Compound ID: | V013-0034 |
| Compound Name: | ethyl 1-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}piperidine-3-carboxylate |
| Molecular Weight: | 477.56 |
| Molecular Formula: | C27 H31 N3 O5 |
| Smiles: | CCOC(C1CCCN(C1)CC(N1C(CC(c2ccc(C)cc2)=N1)c1ccc2c(c1)OCO2)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.3082 |
| logD: | 4.2941 |
| logSw: | -4.1264 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.394 |
| InChI Key: | VWVRUHJISYNBPY-UHFFFAOYSA-N |