ethyl 1-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(4-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}piperidine-2-carboxylate
Chemical Structure Depiction of
ethyl 1-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(4-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}piperidine-2-carboxylate
ethyl 1-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(4-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}piperidine-2-carboxylate
Compound characteristics
| Compound ID: | V005-5825 |
| Compound Name: | ethyl 1-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(4-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}piperidine-2-carboxylate |
| Molecular Weight: | 481.52 |
| Molecular Formula: | C26 H28 F N3 O5 |
| Salt: | not_available |
| Smiles: | CCOC(C1CCCCN1CC(N1C(CC(c2ccc(cc2)F)=N1)c1ccc2c(c1)OCO2)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.2794 |
| logD: | 4.2785 |
| logSw: | -4.1756 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.32 |
| InChI Key: | MDNWLEKZKHZTMQ-UHFFFAOYSA-N |