N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)cyclopropanecarboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)cyclopropanecarboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)cyclopropanecarboxamide
Compound characteristics
Compound ID: | V001-0972 |
Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)cyclopropanecarboxamide |
Molecular Weight: | 529.6 |
Molecular Formula: | C29 H31 N5 O5 |
Salt: | not_available |
Smiles: | COc1cccc(c1)c1ccc(nn1)N1CCN(CC1)C(CN(Cc1ccc2c(c1)OCO2)C(C1CC1)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.287 |
logD: | 3.1751 |
logSw: | -3.4171 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 81.948 |
InChI Key: | PAWZNHOHNKDATL-UHFFFAOYSA-N |