3-(2,4-Dimethoxybenzylidene)Anabaseine
TL;DR: 3-(2,4-Dimethoxybenzylidene)Anabaseine (CAS 156743-66-7) is a chemical compound with molecular formula C19H22Cl2N2O2 and molecular weight 380.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(5E)-5-[(2,4-dimethoxyphenyl)methylidene]-3,4-dihydro-2H-pyridin-6-yl]pyridine;dihydrochloride
Also Known As: DMBX-anabaseine, Afelimomab, DMXBA, GTS-21 dihydrochloride, DMXB-Anabaseine
| Molecular Formula | C19H22Cl2N2O2 |
|---|---|
| Molecular Weight | 380.11 g/mol |
| LogP | 4.6089 |
| Topological Polar Surface Area | 43.71 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 380.10583 |
| Heavy Atoms | 25 |
| Complexity | 746.34424 |
Chemical Identifiers
| CAS Number | 156743-66-7 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)/C=C/2\CCCN=C2C3=CN=CC=C3)OC.Cl.Cl |
Product Overview
3-(2,4-Dimethoxybenzylidene)Anabaseine (CAS 156743-66-7), with molecular formula C19H22Cl2N2O2 and molecular weight 380.11 g/mol. IUPAC: 3-[(5E)-5-[(2,4-dimethoxyphenyl)methylidene]-3,4-dihydro-2H-pyridin-6-yl]pyridine;dihydrochloride.
Chemical Property Profile of 3-(2,4-Dimethoxybenzylidene)Anabaseine
Property Insights of 3-(2,4-Dimethoxybenzylidene)Anabaseine
The XLogP value of 4.6089 indicates that 3-(2,4-Dimethoxybenzylidene)Anabaseine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.71 Ų, 3-(2,4-Dimethoxybenzylidene)Anabaseine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2,4-Dimethoxybenzylidene)Anabaseine has 0 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 3-(2,4-Dimethoxybenzylidene)Anabaseine?
The CAS number of 3-(2,4-Dimethoxybenzylidene)Anabaseine is 156743-66-7.
What is the molecular formula of 3-(2,4-Dimethoxybenzylidene)Anabaseine?
The molecular formula of 3-(2,4-Dimethoxybenzylidene)Anabaseine is C19H22Cl2N2O2.
What is the molecular weight of 3-(2,4-Dimethoxybenzylidene)Anabaseine?
The molecular weight of 3-(2,4-Dimethoxybenzylidene)Anabaseine is 380.11 g/mol.
Where can I buy 3-(2,4-Dimethoxybenzylidene)Anabaseine?
You can request a quote for 3-(2,4-Dimethoxybenzylidene)Anabaseine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2,4-Dimethoxybenzylidene)Anabaseine?
Yes, KEHONG BIO provides custom synthesis services for 3-(2,4-Dimethoxybenzylidene)Anabaseine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.