6-(6-chloro-2H-1,3-benzodioxol-5-yl)-5-nitropiperidin-2-one
Chemical Structure Depiction of
6-(6-chloro-2H-1,3-benzodioxol-5-yl)-5-nitropiperidin-2-one
6-(6-chloro-2H-1,3-benzodioxol-5-yl)-5-nitropiperidin-2-one
Compound characteristics
| Compound ID: | 8012-9465 |
| Compound Name: | 6-(6-chloro-2H-1,3-benzodioxol-5-yl)-5-nitropiperidin-2-one |
| Molecular Weight: | 298.68 |
| Molecular Formula: | C12 H11 Cl N2 O5 |
| Smiles: | C1CC(NC(C1[N+]([O-])=O)c1cc2c(cc1[Cl])OCO2)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.395 |
| logD: | 0.466 |
| logSw: | -2.7268 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.375 |
| InChI Key: | ISQNUCJEUYXRGA-UHFFFAOYSA-N |