3-(3,4-dimethyl-7-oxo-2-phenyl-2,7-dihydro-6H-pyrazolo[3,4-d]pyridazin-6-yl)-N-[(4-ethoxyphenyl)methyl]propanamide
Chemical Structure Depiction of
3-(3,4-dimethyl-7-oxo-2-phenyl-2,7-dihydro-6H-pyrazolo[3,4-d]pyridazin-6-yl)-N-[(4-ethoxyphenyl)methyl]propanamide
3-(3,4-dimethyl-7-oxo-2-phenyl-2,7-dihydro-6H-pyrazolo[3,4-d]pyridazin-6-yl)-N-[(4-ethoxyphenyl)methyl]propanamide
Compound characteristics
Compound ID: | E854-2576 |
Compound Name: | 3-(3,4-dimethyl-7-oxo-2-phenyl-2,7-dihydro-6H-pyrazolo[3,4-d]pyridazin-6-yl)-N-[(4-ethoxyphenyl)methyl]propanamide |
Molecular Weight: | 445.52 |
Molecular Formula: | C25 H27 N5 O3 |
Smiles: | CCOc1ccc(CNC(CCN2C(c3c(C(C)=N2)c(C)n(c2ccccc2)n3)=O)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 2.9273 |
logD: | 2.9261 |
logSw: | -3.2153 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 72.916 |
InChI Key: | CRWSXMFTZSQAPH-UHFFFAOYSA-N |