5-Nitro-6-(2,3,4-trimethoxyphenyl)piperidin-2-one
TL;DR: 5-Nitro-6-(2,3,4-trimethoxyphenyl)piperidin-2-one (CAS 346715-64-8) is a chemical compound with molecular formula C14H18N2O6 and molecular weight 310.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-nitro-6-(2,3,4-trimethoxyphenyl)piperidin-2-one
Also Known As: 5-nitro-6-(2,3,4-trimethoxyphenyl)piperidin-2-one, BAS 04378084, BIM-0022380.P001, 5-Nitro-6-(2,3,4-trimethoxy-phenyl)-piperidin-2-one
| Molecular Formula | C14H18N2O6 |
|---|---|
| Molecular Weight | 310.12 g/mol |
| LogP | 1.3088 |
| Topological Polar Surface Area | 99.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 310.1165 |
| Heavy Atoms | 22 |
| Complexity | 588.941 |
Chemical Identifiers
| CAS Number | 346715-64-8 |
|---|---|
| SMILES | COC1=C(C(=C(C=C1)C2C(CCC(=O)N2)[N+](=O)[O-])OC)OC |
Product Overview
5-Nitro-6-(2,3,4-trimethoxyphenyl)piperidin-2-one (CAS 346715-64-8), with molecular formula C14H18N2O6 and molecular weight 310.12 g/mol. IUPAC: 5-nitro-6-(2,3,4-trimethoxyphenyl)piperidin-2-one.
Chemical Property Profile of 5-Nitro-6-(2,3,4-trimethoxyphenyl)piperidin-2-one
Property Insights of 5-Nitro-6-(2,3,4-trimethoxyphenyl)piperidin-2-one
The XLogP value of 1.3088 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Nitro-6-(2,3,4-trimethoxyphenyl)piperidin-2-one. The TPSA of 99.93 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Nitro-6-(2,3,4-trimethoxyphenyl)piperidin-2-one. Following Lipinski's Rule of Five, 5-Nitro-6-(2,3,4-trimethoxyphenyl)piperidin-2-one has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-Nitro-6-(2,3,4-trimethoxyphenyl)piperidin-2-one?
The CAS number of 5-Nitro-6-(2,3,4-trimethoxyphenyl)piperidin-2-one is 346715-64-8.
What is the molecular formula of 5-Nitro-6-(2,3,4-trimethoxyphenyl)piperidin-2-one?
The molecular formula of 5-Nitro-6-(2,3,4-trimethoxyphenyl)piperidin-2-one is C14H18N2O6.
What is the molecular weight of 5-Nitro-6-(2,3,4-trimethoxyphenyl)piperidin-2-one?
The molecular weight of 5-Nitro-6-(2,3,4-trimethoxyphenyl)piperidin-2-one is 310.12 g/mol.
Where can I buy 5-Nitro-6-(2,3,4-trimethoxyphenyl)piperidin-2-one?
You can request a quote for 5-Nitro-6-(2,3,4-trimethoxyphenyl)piperidin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Nitro-6-(2,3,4-trimethoxyphenyl)piperidin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 5-Nitro-6-(2,3,4-trimethoxyphenyl)piperidin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.