N-benzyl-N-methyl-1-(4-nitrophenyl)-5-phenyl-1H-pyrazole-4-carboxamide
Chemical Structure Depiction of
N-benzyl-N-methyl-1-(4-nitrophenyl)-5-phenyl-1H-pyrazole-4-carboxamide
N-benzyl-N-methyl-1-(4-nitrophenyl)-5-phenyl-1H-pyrazole-4-carboxamide
Compound characteristics
Compound ID: | V025-7687 |
Compound Name: | N-benzyl-N-methyl-1-(4-nitrophenyl)-5-phenyl-1H-pyrazole-4-carboxamide |
Molecular Weight: | 412.45 |
Molecular Formula: | C24 H20 N4 O3 |
Smiles: | CN(Cc1ccccc1)C(c1cnn(c2ccc(cc2)[N+]([O-])=O)c1c1ccccc1)=O |
Stereo: | ACHIRAL |
logP: | 4.7866 |
logD: | 4.7866 |
logSw: | -4.549 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 62.593 |
InChI Key: | KWUCWMJZXYCOCT-UHFFFAOYSA-N |