(4-Bromo-benzylidene)-(2-(3,4-dimethoxy-phenyl)-ethyl)-amine
TL;DR: (4-Bromo-benzylidene)-(2-(3,4-dimethoxy-phenyl)-ethyl)-amine (CAS 96315-77-4) is a chemical compound with molecular formula C17H18BrNO2 and molecular weight 347.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-bromophenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]methanimine
Also Known As: (4-BROMO-BENZYLIDENE)-(2-(3,4-DIMETHOXY-PHENYL)-ETHYL)-AMINE, 1-(4-bromophenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]methanimine, 4-[(3E)-4-(4-bromophenyl)-3-azabut-3-enyl]-1,2-dimethoxybenzene, 684-982-1, RefChem:402525
| Molecular Formula | C17H18BrNO2 |
|---|---|
| Molecular Weight | 347.05 g/mol |
| LogP | 4.1279 |
| Topological Polar Surface Area | 30.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 347.0521 |
| Heavy Atoms | 21 |
| Complexity | 608.6872 |
Chemical Identifiers
| CAS Number | 96315-77-4 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CCN=CC2=CC=C(C=C2)Br)OC |
Product Overview
(4-Bromo-benzylidene)-(2-(3,4-dimethoxy-phenyl)-ethyl)-amine (CAS 96315-77-4), with molecular formula C17H18BrNO2 and molecular weight 347.05 g/mol. IUPAC: 1-(4-bromophenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]methanimine.
Chemical Property Profile of (4-Bromo-benzylidene)-(2-(3,4-dimethoxy-phenyl)-ethyl)-amine
Property Insights of (4-Bromo-benzylidene)-(2-(3,4-dimethoxy-phenyl)-ethyl)-amine
The XLogP value of 4.1279 indicates that (4-Bromo-benzylidene)-(2-(3,4-dimethoxy-phenyl)-ethyl)-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.82 Ų, (4-Bromo-benzylidene)-(2-(3,4-dimethoxy-phenyl)-ethyl)-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Bromo-benzylidene)-(2-(3,4-dimethoxy-phenyl)-ethyl)-amine has 0 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 (4-Bromo-benzylidene)-(2-(3,4-dimethoxy-phenyl)-ethyl)-amine?
The CAS number of (4-Bromo-benzylidene)-(2-(3,4-dimethoxy-phenyl)-ethyl)-amine is 96315-77-4.
What is the molecular formula of (4-Bromo-benzylidene)-(2-(3,4-dimethoxy-phenyl)-ethyl)-amine?
The molecular formula of (4-Bromo-benzylidene)-(2-(3,4-dimethoxy-phenyl)-ethyl)-amine is C17H18BrNO2.
What is the molecular weight of (4-Bromo-benzylidene)-(2-(3,4-dimethoxy-phenyl)-ethyl)-amine?
The molecular weight of (4-Bromo-benzylidene)-(2-(3,4-dimethoxy-phenyl)-ethyl)-amine is 347.05 g/mol.
Where can I buy (4-Bromo-benzylidene)-(2-(3,4-dimethoxy-phenyl)-ethyl)-amine?
You can request a quote for (4-Bromo-benzylidene)-(2-(3,4-dimethoxy-phenyl)-ethyl)-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Bromo-benzylidene)-(2-(3,4-dimethoxy-phenyl)-ethyl)-amine?
Yes, KEHONG BIO provides custom synthesis services for (4-Bromo-benzylidene)-(2-(3,4-dimethoxy-phenyl)-ethyl)-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.