4-{5-chloro-4-[4-(2-methoxyphenyl)piperazin-1-yl]-6-oxopyridazin-1(6H)-yl}benzoic acid
Chemical Structure Depiction of
4-{5-chloro-4-[4-(2-methoxyphenyl)piperazin-1-yl]-6-oxopyridazin-1(6H)-yl}benzoic acid
4-{5-chloro-4-[4-(2-methoxyphenyl)piperazin-1-yl]-6-oxopyridazin-1(6H)-yl}benzoic acid
Compound characteristics
Compound ID: | L394-0030 |
Compound Name: | 4-{5-chloro-4-[4-(2-methoxyphenyl)piperazin-1-yl]-6-oxopyridazin-1(6H)-yl}benzoic acid |
Molecular Weight: | 440.89 |
Molecular Formula: | C22 H21 Cl N4 O4 |
Smiles: | COc1ccccc1N1CCN(CC1)C1C=NN(C(C=1[Cl])=O)c1ccc(cc1)C(O)=O |
Stereo: | ACHIRAL |
logP: | 3.6433 |
logD: | 1.2481 |
logSw: | -3.9687 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 69.986 |
InChI Key: | FKBLDYAFPPTGMM-UHFFFAOYSA-N |