ethyl 1-{2-[3-(2-chlorophenyl)-5-(1-methyl-1H-pyrrol-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}piperidine-3-carboxylate
Chemical Structure Depiction of
ethyl 1-{2-[3-(2-chlorophenyl)-5-(1-methyl-1H-pyrrol-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}piperidine-3-carboxylate
ethyl 1-{2-[3-(2-chlorophenyl)-5-(1-methyl-1H-pyrrol-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}piperidine-3-carboxylate
Compound characteristics
| Compound ID: | V012-9653 |
| Compound Name: | ethyl 1-{2-[3-(2-chlorophenyl)-5-(1-methyl-1H-pyrrol-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}piperidine-3-carboxylate |
| Molecular Weight: | 456.97 |
| Molecular Formula: | C24 H29 Cl N4 O3 |
| Salt: | not_available |
| Smiles: | CCOC(C1CCCN(C1)CC(N1C(CC(c2ccccc2[Cl])=N1)c1cccn1C)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.8787 |
| logD: | 3.8607 |
| logSw: | -4.2549 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.695 |
| InChI Key: | GDMVVNFTBZQECJ-UHFFFAOYSA-N |