2-(3-methylpiperidin-1-yl)-2-(6-nitro-2H-1,3-benzodioxol-5-yl)-N-[4-(propan-2-yl)phenyl]acetamide
Chemical Structure Depiction of
2-(3-methylpiperidin-1-yl)-2-(6-nitro-2H-1,3-benzodioxol-5-yl)-N-[4-(propan-2-yl)phenyl]acetamide
2-(3-methylpiperidin-1-yl)-2-(6-nitro-2H-1,3-benzodioxol-5-yl)-N-[4-(propan-2-yl)phenyl]acetamide
Compound characteristics
| Compound ID: | C094-0170 |
| Compound Name: | 2-(3-methylpiperidin-1-yl)-2-(6-nitro-2H-1,3-benzodioxol-5-yl)-N-[4-(propan-2-yl)phenyl]acetamide |
| Molecular Weight: | 439.51 |
| Molecular Formula: | C24 H29 N3 O5 |
| Smiles: | CC1CCCN(C1)C(C(Nc1ccc(cc1)C(C)C)=O)c1cc2c(cc1[N+]([O-])=O)OCO2 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.1007 |
| logD: | 5.082 |
| logSw: | -4.9198 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.484 |
| InChI Key: | GDTJARVTKFOISF-UHFFFAOYSA-N |