![1-[(2-Bromo-4,5-dimethoxyphenyl)(3-methoxyphenyl)methyl]piperidine-3-carboxylic acid structure](/static/products/5117/5117-38-4.webp)
1-[(2-Bromo-4,5-dimethoxyphenyl)(3-methoxyphenyl)methyl]piperidine-3-carboxylic acid
TL;DR: 1-[(2-Bromo-4,5-dimethoxyphenyl)(3-methoxyphenyl)methyl]piperidine-3-carboxylic acid (CAS 5117-38-4) is a chemical compound with molecular formula C22H26BrNO5 and molecular weight 463.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2-bromo-4,5-dimethoxyphenyl)-(3-methoxyphenyl)methyl]piperidine-3-carboxylic acid
Also Known As: 1-[(2-Bromo-4,5-dimethoxyphenyl)(3-methoxyphenyl)methyl]piperidine-3-carboxylic acid, 1-[(2-bromo-4,5-dimethoxy-phenyl)-(3-methoxyphenyl)methyl]piperidine-3-carboxylic Acid, 1-[(2-bromo-4,5-dimethoxyphenyl)-(3-methoxyphenyl)methyl]piperidine-3-carboxylic acid
| Molecular Formula | C22H26BrNO5 |
|---|---|
| Molecular Weight | 463.10 g/mol |
| LogP | 4.3609 |
| Topological Polar Surface Area | 68.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 463.09943 |
| Heavy Atoms | 29 |
| Complexity | 872.2763 |
Chemical Identifiers
| CAS Number | 5117-38-4 |
|---|---|
| SMILES | COC1=CC=CC(=C1)C(C2=CC(=C(C=C2Br)OC)OC)N3CCCC(C3)C(=O)O |
Product Overview
1-[(2-Bromo-4,5-dimethoxyphenyl)(3-methoxyphenyl)methyl]piperidine-3-carboxylic acid (CAS 5117-38-4), with molecular formula C22H26BrNO5 and molecular weight 463.10 g/mol. IUPAC: 1-[(2-bromo-4,5-dimethoxyphenyl)-(3-methoxyphenyl)methyl]piperidine-3-carboxylic acid.
Chemical Property Profile of 1-[(2-Bromo-4,5-dimethoxyphenyl)(3-methoxyphenyl)methyl]piperidine-3-carboxylic acid
Property Insights of 1-[(2-Bromo-4,5-dimethoxyphenyl)(3-methoxyphenyl)methyl]piperidine-3-carboxylic acid
The XLogP value of 4.3609 indicates that 1-[(2-Bromo-4,5-dimethoxyphenyl)(3-methoxyphenyl)methyl]piperidine-3-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.23 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[(2-Bromo-4,5-dimethoxyphenyl)(3-methoxyphenyl)methyl]piperidine-3-carboxylic acid. Following Lipinski's Rule of Five, 1-[(2-Bromo-4,5-dimethoxyphenyl)(3-methoxyphenyl)methyl]piperidine-3-carboxylic acid has 1 hydrogen bond donor(s) and 5 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 1-[(2-Bromo-4,5-dimethoxyphenyl)(3-methoxyphenyl)methyl]piperidine-3-carboxylic acid?
The CAS number of 1-[(2-Bromo-4,5-dimethoxyphenyl)(3-methoxyphenyl)methyl]piperidine-3-carboxylic acid is 5117-38-4.
What is the molecular formula of 1-[(2-Bromo-4,5-dimethoxyphenyl)(3-methoxyphenyl)methyl]piperidine-3-carboxylic acid?
The molecular formula of 1-[(2-Bromo-4,5-dimethoxyphenyl)(3-methoxyphenyl)methyl]piperidine-3-carboxylic acid is C22H26BrNO5.
What is the molecular weight of 1-[(2-Bromo-4,5-dimethoxyphenyl)(3-methoxyphenyl)methyl]piperidine-3-carboxylic acid?
The molecular weight of 1-[(2-Bromo-4,5-dimethoxyphenyl)(3-methoxyphenyl)methyl]piperidine-3-carboxylic acid is 463.10 g/mol.
Where can I buy 1-[(2-Bromo-4,5-dimethoxyphenyl)(3-methoxyphenyl)methyl]piperidine-3-carboxylic acid?
You can request a quote for 1-[(2-Bromo-4,5-dimethoxyphenyl)(3-methoxyphenyl)methyl]piperidine-3-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(2-Bromo-4,5-dimethoxyphenyl)(3-methoxyphenyl)methyl]piperidine-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-[(2-Bromo-4,5-dimethoxyphenyl)(3-methoxyphenyl)methyl]piperidine-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.