4-{4-[2-(5-fluoro-2-nitrophenoxy)acetamido]-1H-pyrazol-1-yl}butanoic acid
Chemical Structure Depiction of
4-{4-[2-(5-fluoro-2-nitrophenoxy)acetamido]-1H-pyrazol-1-yl}butanoic acid
4-{4-[2-(5-fluoro-2-nitrophenoxy)acetamido]-1H-pyrazol-1-yl}butanoic acid
Compound characteristics
| Compound ID: | 8016-8434 |
| Compound Name: | 4-{4-[2-(5-fluoro-2-nitrophenoxy)acetamido]-1H-pyrazol-1-yl}butanoic acid |
| Molecular Weight: | 366.3 |
| Molecular Formula: | C15 H15 F N4 O6 |
| Smiles: | C(CC(O)=O)Cn1cc(cn1)NC(COc1cc(ccc1[N+]([O-])=O)F)=O |
| Stereo: | ACHIRAL |
| logP: | 0.4026 |
| logD: | -2.3165 |
| logSw: | -2.1214 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 106.922 |
| InChI Key: | YSYZTLPYTDFLKA-UHFFFAOYSA-N |