6-(3-bromo-4,5-diethoxyphenyl)-5-nitropiperidin-2-one
Chemical Structure Depiction of
6-(3-bromo-4,5-diethoxyphenyl)-5-nitropiperidin-2-one
6-(3-bromo-4,5-diethoxyphenyl)-5-nitropiperidin-2-one
Compound characteristics
| Compound ID: | 8013-7154 |
| Compound Name: | 6-(3-bromo-4,5-diethoxyphenyl)-5-nitropiperidin-2-one |
| Molecular Weight: | 387.23 |
| Molecular Formula: | C15 H19 Br N2 O5 |
| Smiles: | CCOc1cc(cc(c1OCC)[Br])C1C(CCC(N1)=O)[N+]([O-])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.2159 |
| logD: | 1.2868 |
| logSw: | -2.5318 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.767 |
| InChI Key: | ZICZTLFBKFRORI-UHFFFAOYSA-N |