2-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-N-(3-fluorophenyl)benzamide
Chemical Structure Depiction of
2-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-N-(3-fluorophenyl)benzamide
2-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-N-(3-fluorophenyl)benzamide
Compound characteristics
| Compound ID: | Y502-1214 |
| Compound Name: | 2-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-N-(3-fluorophenyl)benzamide |
| Molecular Weight: | 368.37 |
| Molecular Formula: | C19 H17 F N4 O3 |
| Smiles: | Cc1c(c(C)n(Cc2ccccc2C(Nc2cccc(c2)F)=O)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.3289 |
| logD: | 3.3143 |
| logSw: | -3.878 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.391 |
| InChI Key: | RAJSBGVBLXLHDT-UHFFFAOYSA-N |