ethyl [3,5-dimethyl-4-(3-methyl-4-nitrobenzamido)-1H-pyrazol-1-yl]acetate
Chemical Structure Depiction of
ethyl [3,5-dimethyl-4-(3-methyl-4-nitrobenzamido)-1H-pyrazol-1-yl]acetate
ethyl [3,5-dimethyl-4-(3-methyl-4-nitrobenzamido)-1H-pyrazol-1-yl]acetate
Compound characteristics
| Compound ID: | 8016-3616 |
| Compound Name: | ethyl [3,5-dimethyl-4-(3-methyl-4-nitrobenzamido)-1H-pyrazol-1-yl]acetate |
| Molecular Weight: | 360.37 |
| Molecular Formula: | C17 H20 N4 O5 |
| Smiles: | CCOC(Cn1c(C)c(c(C)n1)NC(c1ccc(c(C)c1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5631 |
| logD: | 1.5469 |
| logSw: | -2.4692 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.727 |
| InChI Key: | OOARRHHHGGLYMT-UHFFFAOYSA-N |