1-ethyl-N-[(2-fluorophenyl)methyl]-4-nitro-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
1-ethyl-N-[(2-fluorophenyl)methyl]-4-nitro-1H-pyrazole-3-carboxamide
1-ethyl-N-[(2-fluorophenyl)methyl]-4-nitro-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | 8017-5447 |
| Compound Name: | 1-ethyl-N-[(2-fluorophenyl)methyl]-4-nitro-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 292.27 |
| Molecular Formula: | C13 H13 F N4 O3 |
| Smiles: | CCn1cc(c(C(NCc2ccccc2F)=O)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.7495 |
| logD: | 1.7486 |
| logSw: | -2.0435 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.781 |
| InChI Key: | SMFFBKUPBSTHGK-UHFFFAOYSA-N |