methyl 2-[(4-nitro-1H-pyrazole-3-carbonyl)amino]benzoate
Chemical Structure Depiction of
methyl 2-[(4-nitro-1H-pyrazole-3-carbonyl)amino]benzoate
methyl 2-[(4-nitro-1H-pyrazole-3-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | Y502-1405 |
| Compound Name: | methyl 2-[(4-nitro-1H-pyrazole-3-carbonyl)amino]benzoate |
| Molecular Weight: | 290.23 |
| Molecular Formula: | C12 H10 N4 O5 |
| Smiles: | COC(c1ccccc1NC(c1c(c[nH]n1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6097 |
| logD: | -0.3132 |
| logSw: | -2.3325 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 101.348 |
| InChI Key: | ZJCCAPANHVAOFB-UHFFFAOYSA-N |