ethyl 4-{[3-(4-methylphenyl)-1-phenyl-1H-pyrazol-5-yl]amino}-4-oxobutanoate
Chemical Structure Depiction of
ethyl 4-{[3-(4-methylphenyl)-1-phenyl-1H-pyrazol-5-yl]amino}-4-oxobutanoate
ethyl 4-{[3-(4-methylphenyl)-1-phenyl-1H-pyrazol-5-yl]amino}-4-oxobutanoate
Compound characteristics
Compound ID: | V012-9377 |
Compound Name: | ethyl 4-{[3-(4-methylphenyl)-1-phenyl-1H-pyrazol-5-yl]amino}-4-oxobutanoate |
Molecular Weight: | 377.44 |
Molecular Formula: | C22 H23 N3 O3 |
Smiles: | CCOC(CCC(Nc1cc(c2ccc(C)cc2)nn1c1ccccc1)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.2644 |
logD: | 4.2644 |
logSw: | -4.1723 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 57.71 |
InChI Key: | XJDZUKBOECTMAR-UHFFFAOYSA-N |