N'-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-5-[(4-nitro-1H-pyrazol-1-yl)methyl]-1,2-oxazole-3-carbohydrazide
Chemical Structure Depiction of
N'-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-5-[(4-nitro-1H-pyrazol-1-yl)methyl]-1,2-oxazole-3-carbohydrazide
N'-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-5-[(4-nitro-1H-pyrazol-1-yl)methyl]-1,2-oxazole-3-carbohydrazide
Compound characteristics
| Compound ID: | 8020-3714 |
| Compound Name: | N'-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-5-[(4-nitro-1H-pyrazol-1-yl)methyl]-1,2-oxazole-3-carbohydrazide |
| Molecular Weight: | 414.33 |
| Molecular Formula: | C17 H14 N6 O7 |
| Smiles: | C(c1cc(C(NNC(c2ccc3c(c2)OCCO3)=O)=O)no1)n1cc(cn1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 0.1278 |
| logD: | 0.1276 |
| logSw: | -2.0901 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 136.122 |
| InChI Key: | FCIJPZQOEMYKAJ-UHFFFAOYSA-N |