N-[(4-ethylphenyl)methyl]-1-[2-(4-methoxyphenyl)-3,4-dimethyl-2H-pyrazolo[3,4-d]pyridazin-7-yl]piperidine-3-carboxamide
Chemical Structure Depiction of
N-[(4-ethylphenyl)methyl]-1-[2-(4-methoxyphenyl)-3,4-dimethyl-2H-pyrazolo[3,4-d]pyridazin-7-yl]piperidine-3-carboxamide
N-[(4-ethylphenyl)methyl]-1-[2-(4-methoxyphenyl)-3,4-dimethyl-2H-pyrazolo[3,4-d]pyridazin-7-yl]piperidine-3-carboxamide
Compound characteristics
Compound ID: | E859-1203 |
Compound Name: | N-[(4-ethylphenyl)methyl]-1-[2-(4-methoxyphenyl)-3,4-dimethyl-2H-pyrazolo[3,4-d]pyridazin-7-yl]piperidine-3-carboxamide |
Molecular Weight: | 498.63 |
Molecular Formula: | C29 H34 N6 O2 |
Smiles: | CCc1ccc(CNC(C2CCCN(C2)c2c3c(c(C)nn2)c(C)n(c2ccc(cc2)OC)n3)=O)cc1 |
Stereo: | RACEMIC MIXTURE |
logP: | 4.0481 |
logD: | 4.0296 |
logSw: | -4.2014 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 72.161 |
InChI Key: | QLYTYCIVPKHQRB-QHCPKHFHSA-N |