6-(4-chlorophenyl)-2-{2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}[1,2,4]triazolo[4,3-b]pyridazin-3(2H)-one
Chemical Structure Depiction of
6-(4-chlorophenyl)-2-{2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}[1,2,4]triazolo[4,3-b]pyridazin-3(2H)-one
6-(4-chlorophenyl)-2-{2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}[1,2,4]triazolo[4,3-b]pyridazin-3(2H)-one
Compound characteristics
| Compound ID: | M452-1110 |
| Compound Name: | 6-(4-chlorophenyl)-2-{2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}[1,2,4]triazolo[4,3-b]pyridazin-3(2H)-one |
| Molecular Weight: | 478.94 |
| Molecular Formula: | C24 H23 Cl N6 O3 |
| Smiles: | COc1ccccc1N1CCN(CC1)C(CN1C(N2C(C=CC(c3ccc(cc3)[Cl])=N2)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6216 |
| logD: | 3.6212 |
| logSw: | -4.0875 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 71.739 |
| InChI Key: | XELXZTQAKQUBAY-UHFFFAOYSA-N |