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 380.10583 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
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
Technical Specifications
| Molecular Formula | C19H22Cl2N2O2 |
| Molecular Weight | 380.10583 g/mol |
| XLogP | 4.6089 |
| Topological Polar Surface Area (TPSA) | 43.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 380.10583 Da |
| Heavy Atoms | 25 |
| Complexity | 447.0 |
| SMILES | COC1=CC(=C(C=C1)/C=C/2\CCCN=C2C3=CN=CC=C3)OC.Cl.Cl |
| InChIKey | BXKYFUGAAFLYJL-BXGYHSFXSA-N |
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 43.7 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 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
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 380.10583 g/mol.
Where can I buy 3-(2,4-Dimethoxybenzylidene)Anabaseine?
You can request a quote for 3-(2,4-Dimethoxybenzylidene)Anabaseine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(2,4-Dimethoxybenzylidene)Anabaseine?
Yes, CoreyChem provides custom synthesis services for 3-(2,4-Dimethoxybenzylidene)Anabaseine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.