4-(4-carbamoyl-3-nitro-1H-pyrazol-1-yl)butanoic acid
Chemical Structure Depiction of
4-(4-carbamoyl-3-nitro-1H-pyrazol-1-yl)butanoic acid
4-(4-carbamoyl-3-nitro-1H-pyrazol-1-yl)butanoic acid
Compound characteristics
| Compound ID: | Y507-1115 |
| Compound Name: | 4-(4-carbamoyl-3-nitro-1H-pyrazol-1-yl)butanoic acid |
| Molecular Weight: | 242.19 |
| Molecular Formula: | C8 H10 N4 O5 |
| Smiles: | C(CC(O)=O)Cn1cc(C(N)=O)c(n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | -1.6448 |
| logD: | -4.364 |
| logSw: | -1.263 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 110.527 |
| InChI Key: | KLIWXWNMBVPLRU-UHFFFAOYSA-N |