ethyl 4-[2-(5-methyl-3-nitro-1H-pyrazol-1-yl)acetamido]benzoate
Chemical Structure Depiction of
ethyl 4-[2-(5-methyl-3-nitro-1H-pyrazol-1-yl)acetamido]benzoate
ethyl 4-[2-(5-methyl-3-nitro-1H-pyrazol-1-yl)acetamido]benzoate
Compound characteristics
| Compound ID: | 8016-7307 |
| Compound Name: | ethyl 4-[2-(5-methyl-3-nitro-1H-pyrazol-1-yl)acetamido]benzoate |
| Molecular Weight: | 332.31 |
| Molecular Formula: | C15 H16 N4 O5 |
| Smiles: | CCOC(c1ccc(cc1)NC(Cn1c(C)cc(n1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0421 |
| logD: | 2.042 |
| logSw: | -2.7756 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.915 |
| InChI Key: | ZMDKNWFVAJVZAR-UHFFFAOYSA-N |