4-[2-(4-nitro-1H-pyrazol-1-yl)propanamido]benzoic acid
Chemical Structure Depiction of
4-[2-(4-nitro-1H-pyrazol-1-yl)propanamido]benzoic acid
4-[2-(4-nitro-1H-pyrazol-1-yl)propanamido]benzoic acid
Compound characteristics
| Compound ID: | Y503-3778 |
| Compound Name: | 4-[2-(4-nitro-1H-pyrazol-1-yl)propanamido]benzoic acid |
| Molecular Weight: | 304.26 |
| Molecular Formula: | C13 H12 N4 O5 |
| Smiles: | CC(C(Nc1ccc(cc1)C(O)=O)=O)n1cc(cn1)[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.2846 |
| logD: | -1.1106 |
| logSw: | -2.0191 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 99.701 |
| InChI Key: | SWHQDANMWBNOAV-QMMMGPOBSA-N |