ethyl {5-methyl-3-[(1-methyl-3-nitro-1H-pyrazole-5-carbonyl)amino]-1H-pyrazol-1-yl}acetate
Chemical Structure Depiction of
ethyl {5-methyl-3-[(1-methyl-3-nitro-1H-pyrazole-5-carbonyl)amino]-1H-pyrazol-1-yl}acetate
ethyl {5-methyl-3-[(1-methyl-3-nitro-1H-pyrazole-5-carbonyl)amino]-1H-pyrazol-1-yl}acetate
Compound characteristics
| Compound ID: | 8018-5345 |
| Compound Name: | ethyl {5-methyl-3-[(1-methyl-3-nitro-1H-pyrazole-5-carbonyl)amino]-1H-pyrazol-1-yl}acetate |
| Molecular Weight: | 336.3 |
| Molecular Formula: | C13 H16 N6 O5 |
| Smiles: | CCOC(Cn1c(C)cc(NC(c2cc(nn2C)[N+]([O-])=O)=O)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.2669 |
| logD: | -1.1354 |
| logSw: | -2.1026 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 104.617 |
| InChI Key: | UNUGHNJAIZVUKQ-UHFFFAOYSA-N |