Chelidoninium, 5-methyl-, iodide
TL;DR: Chelidoninium, 5-methyl-, iodide (CAS 72551-84-9) is a chemical compound with molecular formula C21H22INO5 and molecular weight 495.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
12,12-dimethyl-5,7,17,19-tetraoxa-12-azoniahexacyclo[11.11.0.02,10.04,8.014,22.016,20]tetracosa-2,4(8),9,14,16(20),21-hexaen-24-ol iodide
Also Known As: Chelidonine methiodide, Metylojodku chelidoniny, Metylojodku chelidoniny [Polish], Chelidoninium, 5-methyl-, iodide, 12-Hydroxy-5,5-dimethyl-4b,5,6,11b,12,13-hexahydro-2H,9H-[1,3]benzodioxolo[5,6-c][1,3]dioxolo[4,5-j]phenanthridin-5-ium iodide
| Molecular Formula | C21H22INO5 |
|---|---|
| Molecular Weight | 495.05 g/mol |
| LogP | -0.5201 |
| Topological Polar Surface Area | 57.15 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 495.05426 |
| Heavy Atoms | 28 |
| Complexity | 975.75366 |
Chemical Identifiers
| CAS Number | 72551-84-9 |
|---|---|
| SMILES | C[N+]1(CC2=CC3=C(C=C2C4C1C5=CC6=C(C=C5CC4O)OCO6)OCO3)C.[I-] |
Product Overview
Chelidoninium, 5-methyl-, iodide (CAS 72551-84-9), with molecular formula C21H22INO5 and molecular weight 495.05 g/mol. IUPAC: 12,12-dimethyl-5,7,17,19-tetraoxa-12-azoniahexacyclo[11.11.0.02,10.04,8.014,22.016,20]tetracosa-2,4(8),9,14,16(20),21-hexaen-24-ol iodide.
Chemical Property Profile of Chelidoninium, 5-methyl-, iodide
Property Insights of Chelidoninium, 5-methyl-, iodide
The XLogP value of -0.5201 indicates that Chelidoninium, 5-methyl-, iodide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 57.15 Ų, Chelidoninium, 5-methyl-, iodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Chelidoninium, 5-methyl-, iodide has 1 hydrogen bond donor(s) and 5 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 Chelidoninium, 5-methyl-, iodide?
The CAS number of Chelidoninium, 5-methyl-, iodide is 72551-84-9.
What is the molecular formula of Chelidoninium, 5-methyl-, iodide?
The molecular formula of Chelidoninium, 5-methyl-, iodide is C21H22INO5.
What is the molecular weight of Chelidoninium, 5-methyl-, iodide?
The molecular weight of Chelidoninium, 5-methyl-, iodide is 495.05 g/mol.
Where can I buy Chelidoninium, 5-methyl-, iodide?
You can request a quote for Chelidoninium, 5-methyl-, iodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Chelidoninium, 5-methyl-, iodide?
Yes, KEHONG BIO provides custom synthesis services for Chelidoninium, 5-methyl-, iodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.