(3-carbamoyl-4-nitro-1H-pyrazol-1-yl)acetic acid
Chemical Structure Depiction of
(3-carbamoyl-4-nitro-1H-pyrazol-1-yl)acetic acid
(3-carbamoyl-4-nitro-1H-pyrazol-1-yl)acetic acid
Compound characteristics
| Compound ID: | Y507-1114 |
| Compound Name: | (3-carbamoyl-4-nitro-1H-pyrazol-1-yl)acetic acid |
| Molecular Weight: | 214.13 |
| Molecular Formula: | C6 H6 N4 O5 |
| Smiles: | C(C(O)=O)n1cc(c(C(N)=O)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | -2.2796 |
| logD: | -6.0058 |
| logSw: | -0.6931 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 111.086 |
| InChI Key: | TWNABUOYKWLIFX-UHFFFAOYSA-N |