methyl (1-{[3-(2-chlorophenyl)-6-oxopyridazin-1(6H)-yl]acetyl}piperidin-4-yl)acetate
Chemical Structure Depiction of
methyl (1-{[3-(2-chlorophenyl)-6-oxopyridazin-1(6H)-yl]acetyl}piperidin-4-yl)acetate
methyl (1-{[3-(2-chlorophenyl)-6-oxopyridazin-1(6H)-yl]acetyl}piperidin-4-yl)acetate
Compound characteristics
| Compound ID: | Y041-9315 |
| Compound Name: | methyl (1-{[3-(2-chlorophenyl)-6-oxopyridazin-1(6H)-yl]acetyl}piperidin-4-yl)acetate |
| Molecular Weight: | 403.86 |
| Molecular Formula: | C20 H22 Cl N3 O4 |
| Smiles: | COC(CC1CCN(CC1)C(CN1C(C=CC(c2ccccc2[Cl])=N1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2737 |
| logD: | 2.2737 |
| logSw: | -3.2435 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.519 |
| InChI Key: | WNUBLTZARWDBOQ-UHFFFAOYSA-N |