2-[(1-methyl-4-nitro-1H-pyrazole-5-carbonyl)amino]benzoic acid
Chemical Structure Depiction of
2-[(1-methyl-4-nitro-1H-pyrazole-5-carbonyl)amino]benzoic acid
2-[(1-methyl-4-nitro-1H-pyrazole-5-carbonyl)amino]benzoic acid
Compound characteristics
| Compound ID: | 3567-0555 |
| Compound Name: | 2-[(1-methyl-4-nitro-1H-pyrazole-5-carbonyl)amino]benzoic acid |
| Molecular Weight: | 290.23 |
| Molecular Formula: | C12 H10 N4 O5 |
| Smiles: | Cn1c(C(Nc2ccccc2C(O)=O)=O)c(cn1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.643 |
| logD: | -3.1831 |
| logSw: | -2.292 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 97.636 |
| InChI Key: | VGCFUWXBUDSUAA-UHFFFAOYSA-N |