O-Methylfagaronine iodide
TL;DR: O-Methylfagaronine iodide (CAS 136540-26-6) is a chemical compound with molecular formula C22H22INO4 and molecular weight 491.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,8,9-tetramethoxy-5-methylbenzo[c]phenanthridin-5-ium iodide
Also Known As: O-Methylfagaronine iodide, O-Methylfagaronine iodide hydrate, 2,3,8,9-tetramethoxy-5-methylbenzo[c]phenanthridin-5-ium iodide, Benzo(c)phenanthridinium, 5-methyl-2,3,8,9-tetramethoxy-, iodide, Benzo(c)phenanthridinium, 5-methyl-2,3,8,9-tetramethoxy-, iodide, hydrate
| Molecular Formula | C22H22INO4 |
|---|---|
| Molecular Weight | 491.06 g/mol |
| LogP | 1.0091 |
| Topological Polar Surface Area | 40.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 491.05936 |
| Heavy Atoms | 28 |
| Complexity | 1190.1603 |
Chemical Identifiers
| CAS Number | 136540-26-6 |
|---|---|
| SMILES | C[N+]1=CC2=CC(=C(C=C2C3=C1C4=CC(=C(C=C4C=C3)OC)OC)OC)OC.[I-] |
Product Overview
O-Methylfagaronine iodide (CAS 136540-26-6), with molecular formula C22H22INO4 and molecular weight 491.06 g/mol. IUPAC: 2,3,8,9-tetramethoxy-5-methylbenzo[c]phenanthridin-5-ium iodide.
Chemical Property Profile of O-Methylfagaronine iodide
Property Insights of O-Methylfagaronine iodide
The XLogP value of 1.0091 suggests moderate lipophilicity, balancing water solubility and membrane permeability for O-Methylfagaronine iodide. With a topological polar surface area (TPSA) of 40.8 Ų, O-Methylfagaronine iodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, O-Methylfagaronine iodide 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 O-Methylfagaronine iodide?
The CAS number of O-Methylfagaronine iodide is 136540-26-6.
What is the molecular formula of O-Methylfagaronine iodide?
The molecular formula of O-Methylfagaronine iodide is C22H22INO4.
What is the molecular weight of O-Methylfagaronine iodide?
The molecular weight of O-Methylfagaronine iodide is 491.06 g/mol.
Where can I buy O-Methylfagaronine iodide?
You can request a quote for O-Methylfagaronine iodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for O-Methylfagaronine iodide?
Yes, KEHONG BIO provides custom synthesis services for O-Methylfagaronine iodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.