4-[4-(4-chloro-3-nitrobenzamido)-1H-pyrazol-1-yl]butanoic acid
Chemical Structure Depiction of
4-[4-(4-chloro-3-nitrobenzamido)-1H-pyrazol-1-yl]butanoic acid
4-[4-(4-chloro-3-nitrobenzamido)-1H-pyrazol-1-yl]butanoic acid
Compound characteristics
| Compound ID: | 8016-6765 |
| Compound Name: | 4-[4-(4-chloro-3-nitrobenzamido)-1H-pyrazol-1-yl]butanoic acid |
| Molecular Weight: | 352.73 |
| Molecular Formula: | C14 H13 Cl N4 O5 |
| Smiles: | C(CC(O)=O)Cn1cc(cn1)NC(c1ccc(c(c1)[N+]([O-])=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 0.7056 |
| logD: | -2.0136 |
| logSw: | -2.6848 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 99.55 |
| InChI Key: | MWCJHTUBXXMEJW-UHFFFAOYSA-N |