![2-Bromo-4,5-dimethoxy-N-[1-methyl-4-diethylaminobutyl]aniline structure](/static/products/6691/66910-68-7.webp)
2-Bromo-4,5-dimethoxy-N-[1-methyl-4-diethylaminobutyl]aniline
TL;DR: 2-Bromo-4,5-dimethoxy-N-[1-methyl-4-diethylaminobutyl]aniline (CAS 66910-68-7) is a chemical compound with molecular formula C17H29BrN2O2 and molecular weight 372.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-N-(2-bromo-4,5-dimethoxyphenyl)-1-N,1-N-diethylpentane-1,4-diamine
Also Known As: 1-n-Butyl-4-nitropiperidin, 2-Bromo-4,5-dimethoxy-N-[1-methyl-4-diethylaminobutyl]aniline, 4-N-(2-bromo-4,5-dimethoxyphenyl)-1-N,1-N-diethylpentane-1,4-diamine, N~4~-(2-Bromo-4,5-dimethoxyphenyl)-N~1~,N~1~-diethylpentane-1,4-diamine
| Molecular Formula | C17H29BrN2O2 |
|---|---|
| Molecular Weight | 372.14 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 33.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 372.14124 |
| Heavy Atoms | 22 |
| Complexity | 290.0 |
Chemical Identifiers
| CAS Number | 66910-68-7 |
|---|---|
| SMILES | CCN(CC)CCCC(C)NC1=CC(=C(C=C1Br)OC)OC |
| InChIKey | DNVIOYJGGDGNFA-UHFFFAOYSA-N |
Product Overview
2-Bromo-4,5-dimethoxy-N-[1-methyl-4-diethylaminobutyl]aniline (CAS 66910-68-7), with molecular formula C17H29BrN2O2 and molecular weight 372.14 g/mol. IUPAC: 4-N-(2-bromo-4,5-dimethoxyphenyl)-1-N,1-N-diethylpentane-1,4-diamine.
Chemical Property Profile of 2-Bromo-4,5-dimethoxy-N-[1-methyl-4-diethylaminobutyl]aniline
Property Insights of 2-Bromo-4,5-dimethoxy-N-[1-methyl-4-diethylaminobutyl]aniline
The XLogP value of 4.5 indicates that 2-Bromo-4,5-dimethoxy-N-[1-methyl-4-diethylaminobutyl]aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 33.7 Ų, 2-Bromo-4,5-dimethoxy-N-[1-methyl-4-diethylaminobutyl]aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Bromo-4,5-dimethoxy-N-[1-methyl-4-diethylaminobutyl]aniline has 1 hydrogen bond donor(s) and 4 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 2-Bromo-4,5-dimethoxy-N-[1-methyl-4-diethylaminobutyl]aniline?
The CAS number of 2-Bromo-4,5-dimethoxy-N-[1-methyl-4-diethylaminobutyl]aniline is 66910-68-7.
What is the molecular formula of 2-Bromo-4,5-dimethoxy-N-[1-methyl-4-diethylaminobutyl]aniline?
The molecular formula of 2-Bromo-4,5-dimethoxy-N-[1-methyl-4-diethylaminobutyl]aniline is C17H29BrN2O2.
What is the molecular weight of 2-Bromo-4,5-dimethoxy-N-[1-methyl-4-diethylaminobutyl]aniline?
The molecular weight of 2-Bromo-4,5-dimethoxy-N-[1-methyl-4-diethylaminobutyl]aniline is 372.14 g/mol.
Where can I buy 2-Bromo-4,5-dimethoxy-N-[1-methyl-4-diethylaminobutyl]aniline?
You can request a quote for 2-Bromo-4,5-dimethoxy-N-[1-methyl-4-diethylaminobutyl]aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Bromo-4,5-dimethoxy-N-[1-methyl-4-diethylaminobutyl]aniline?
Yes, KEHONG BIO provides custom synthesis services for 2-Bromo-4,5-dimethoxy-N-[1-methyl-4-diethylaminobutyl]aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.