2-(3,5-dimethylpiperidin-1-yl)-N-(4-methoxyphenyl)-2-(6-nitro-2H-1,3-benzodioxol-5-yl)acetamide
Chemical Structure Depiction of
2-(3,5-dimethylpiperidin-1-yl)-N-(4-methoxyphenyl)-2-(6-nitro-2H-1,3-benzodioxol-5-yl)acetamide
2-(3,5-dimethylpiperidin-1-yl)-N-(4-methoxyphenyl)-2-(6-nitro-2H-1,3-benzodioxol-5-yl)acetamide
Compound characteristics
| Compound ID: | C094-0151 |
| Compound Name: | 2-(3,5-dimethylpiperidin-1-yl)-N-(4-methoxyphenyl)-2-(6-nitro-2H-1,3-benzodioxol-5-yl)acetamide |
| Molecular Weight: | 441.48 |
| Molecular Formula: | C23 H27 N3 O6 |
| Smiles: | CC1CC(C)CN(C1)C(C(Nc1ccc(cc1)OC)=O)c1cc2c(cc1[N+]([O-])=O)OCO2 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.3822 |
| logD: | 4.3645 |
| logSw: | -4.3745 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.961 |
| InChI Key: | PSNZJLQSLBJKCF-UHFFFAOYSA-N |