1-(3-bromo-4,5-diethoxyphenyl)-N-methylmethanamine
TL;DR: 1-(3-bromo-4,5-diethoxyphenyl)-N-methylmethanamine (CAS 774554-40-4) is a chemical compound with molecular formula C12H18BrNO2 and molecular weight 287.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-bromo-4,5-diethoxyphenyl)-N-methylmethanamine
Also Known As: 1-(3-bromo-4,5-diethoxyphenyl)-N-methylmethanamine, N-(3-bromo-4,5-diethoxybenzyl)-N-methylamine, (3-Bromo-4,5-diethoxy-benzyl)-methyl-amine, AN-465/42518774, [(3-bromo-4,5-diethoxyphenyl)methyl]methylamine
| Molecular Formula | C12H18BrNO2 |
|---|---|
| Molecular Weight | 287.05 g/mol |
| LogP | 2.9659 |
| Topological Polar Surface Area | 30.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 287.0521 |
| Heavy Atoms | 16 |
| Complexity | 342.0358 |
Chemical Identifiers
| CAS Number | 774554-40-4 |
|---|---|
| SMILES | CCOC1=C(C(=CC(=C1)CNC)Br)OCC |
Product Overview
1-(3-bromo-4,5-diethoxyphenyl)-N-methylmethanamine (CAS 774554-40-4), with molecular formula C12H18BrNO2 and molecular weight 287.05 g/mol. IUPAC: 1-(3-bromo-4,5-diethoxyphenyl)-N-methylmethanamine.
Chemical Property Profile of 1-(3-bromo-4,5-diethoxyphenyl)-N-methylmethanamine
Property Insights of 1-(3-bromo-4,5-diethoxyphenyl)-N-methylmethanamine
The XLogP value of 2.9659 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3-bromo-4,5-diethoxyphenyl)-N-methylmethanamine. With a topological polar surface area (TPSA) of 30.49 Ų, 1-(3-bromo-4,5-diethoxyphenyl)-N-methylmethanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-bromo-4,5-diethoxyphenyl)-N-methylmethanamine has 1 hydrogen bond donor(s) and 3 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-(3-bromo-4,5-diethoxyphenyl)-N-methylmethanamine?
The CAS number of 1-(3-bromo-4,5-diethoxyphenyl)-N-methylmethanamine is 774554-40-4.
What is the molecular formula of 1-(3-bromo-4,5-diethoxyphenyl)-N-methylmethanamine?
The molecular formula of 1-(3-bromo-4,5-diethoxyphenyl)-N-methylmethanamine is C12H18BrNO2.
What is the molecular weight of 1-(3-bromo-4,5-diethoxyphenyl)-N-methylmethanamine?
The molecular weight of 1-(3-bromo-4,5-diethoxyphenyl)-N-methylmethanamine is 287.05 g/mol.
Where can I buy 1-(3-bromo-4,5-diethoxyphenyl)-N-methylmethanamine?
You can request a quote for 1-(3-bromo-4,5-diethoxyphenyl)-N-methylmethanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-bromo-4,5-diethoxyphenyl)-N-methylmethanamine?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-bromo-4,5-diethoxyphenyl)-N-methylmethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.