4-(5-acetamido-3-methyl-4-phenyl-1H-pyrazol-1-yl)-N-[(2H-1,3-benzodioxol-5-yl)methyl]benzamide
Chemical Structure Depiction of
4-(5-acetamido-3-methyl-4-phenyl-1H-pyrazol-1-yl)-N-[(2H-1,3-benzodioxol-5-yl)methyl]benzamide
4-(5-acetamido-3-methyl-4-phenyl-1H-pyrazol-1-yl)-N-[(2H-1,3-benzodioxol-5-yl)methyl]benzamide
Compound characteristics
| Compound ID: | F944-0075 |
| Compound Name: | 4-(5-acetamido-3-methyl-4-phenyl-1H-pyrazol-1-yl)-N-[(2H-1,3-benzodioxol-5-yl)methyl]benzamide |
| Molecular Weight: | 468.51 |
| Molecular Formula: | C27 H24 N4 O4 |
| Smiles: | CC(Nc1c(c2ccccc2)c(C)nn1c1ccc(cc1)C(NCc1ccc2c(c1)OCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3108 |
| logD: | 3.3108 |
| logSw: | -3.7018 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.848 |
| InChI Key: | MJLWSKCCMHXOPV-UHFFFAOYSA-N |