4-[4-(2-methyl-3-nitrobenzamido)-1H-pyrazol-1-yl]butanoic acid
Chemical Structure Depiction of
4-[4-(2-methyl-3-nitrobenzamido)-1H-pyrazol-1-yl]butanoic acid
4-[4-(2-methyl-3-nitrobenzamido)-1H-pyrazol-1-yl]butanoic acid
Compound characteristics
| Compound ID: | 8016-1091 |
| Compound Name: | 4-[4-(2-methyl-3-nitrobenzamido)-1H-pyrazol-1-yl]butanoic acid |
| Molecular Weight: | 332.31 |
| Molecular Formula: | C15 H16 N4 O5 |
| Smiles: | Cc1c(cccc1[N+]([O-])=O)C(Nc1cnn(CCCC(O)=O)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.7313 |
| logD: | -1.9879 |
| logSw: | -2.2061 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 99.55 |
| InChI Key: | SXISGYIYMGOJIT-UHFFFAOYSA-N |