1-ethyl-N-[(2-fluorophenyl)methyl]-4-nitro-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
1-ethyl-N-[(2-fluorophenyl)methyl]-4-nitro-1H-pyrazole-5-carboxamide
1-ethyl-N-[(2-fluorophenyl)methyl]-4-nitro-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | Y501-1234 |
| Compound Name: | 1-ethyl-N-[(2-fluorophenyl)methyl]-4-nitro-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 292.27 |
| Molecular Formula: | C13 H13 F N4 O3 |
| Smiles: | CCn1c(C(NCc2ccccc2F)=O)c(cn1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.8707 |
| logD: | 1.8639 |
| logSw: | -2.1332 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.687 |
| InChI Key: | RTOMUFMOALXEFU-UHFFFAOYSA-N |