4-[4-(4-nitro-1H-pyrazol-1-yl)butanamido]benzoic acid
Chemical Structure Depiction of
4-[4-(4-nitro-1H-pyrazol-1-yl)butanamido]benzoic acid
4-[4-(4-nitro-1H-pyrazol-1-yl)butanamido]benzoic acid
Compound characteristics
| Compound ID: | Y502-8207 |
| Compound Name: | 4-[4-(4-nitro-1H-pyrazol-1-yl)butanamido]benzoic acid |
| Molecular Weight: | 318.29 |
| Molecular Formula: | C14 H14 N4 O5 |
| Smiles: | C(CC(Nc1ccc(cc1)C(O)=O)=O)Cn1cc(cn1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 0.9372 |
| logD: | -1.4581 |
| logSw: | -1.9987 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 99.661 |
| InChI Key: | NYMNXWCYMPNBPN-UHFFFAOYSA-N |