(4-methoxy-3-nitrophenyl)methyl 4-{[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]amino}-1,2,5-oxadiazole-3-carboxylate
Chemical Structure Depiction of
(4-methoxy-3-nitrophenyl)methyl 4-{[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]amino}-1,2,5-oxadiazole-3-carboxylate
(4-methoxy-3-nitrophenyl)methyl 4-{[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]amino}-1,2,5-oxadiazole-3-carboxylate
Compound characteristics
| Compound ID: | 8011-9954 |
| Compound Name: | (4-methoxy-3-nitrophenyl)methyl 4-{[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]amino}-1,2,5-oxadiazole-3-carboxylate |
| Molecular Weight: | 402.36 |
| Molecular Formula: | C17 H18 N6 O6 |
| Smiles: | Cc1cc(C)n(CNc2c(C(=O)OCc3ccc(c(c3)[N+]([O-])=O)OC)non2)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.8707 |
| logD: | 1.8706 |
| logSw: | -2.3884 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 123.73 |
| InChI Key: | JDAZLXLCEBJTRK-UHFFFAOYSA-N |