N-{1-[(3-fluorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-3-[(4-nitro-1H-pyrazol-1-yl)methyl]benzamide
Chemical Structure Depiction of
N-{1-[(3-fluorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-3-[(4-nitro-1H-pyrazol-1-yl)methyl]benzamide
N-{1-[(3-fluorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-3-[(4-nitro-1H-pyrazol-1-yl)methyl]benzamide
Compound characteristics
| Compound ID: | Y501-7808 |
| Compound Name: | N-{1-[(3-fluorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-3-[(4-nitro-1H-pyrazol-1-yl)methyl]benzamide |
| Molecular Weight: | 448.46 |
| Molecular Formula: | C23 H21 F N6 O3 |
| Smiles: | Cc1c(c(C)n(Cc2cccc(c2)F)n1)NC(c1cccc(Cn2cc(cn2)[N+]([O-])=O)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2298 |
| logD: | 2.2219 |
| logSw: | -2.8179 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.103 |
| InChI Key: | UONWWFOBIVTSAD-UHFFFAOYSA-N |