ethyl 4-[(1-methyl-3-nitro-1H-pyrazole-5-carbonyl)amino]benzoate
Chemical Structure Depiction of
ethyl 4-[(1-methyl-3-nitro-1H-pyrazole-5-carbonyl)amino]benzoate
ethyl 4-[(1-methyl-3-nitro-1H-pyrazole-5-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | 8018-4791 |
| Compound Name: | ethyl 4-[(1-methyl-3-nitro-1H-pyrazole-5-carbonyl)amino]benzoate |
| Molecular Weight: | 318.29 |
| Molecular Formula: | C14 H14 N4 O5 |
| Smiles: | CCOC(c1ccc(cc1)NC(c1cc(nn1C)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.941 |
| logD: | 1.8688 |
| logSw: | -2.6579 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.444 |
| InChI Key: | YPPMDHZTWRNLJF-UHFFFAOYSA-N |