RefChem:1052923
TL;DR: RefChem:1052923 (CAS 20232-95-5) is a chemical compound with molecular formula C46H54I2N2O8 and molecular weight 1016.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(1,3-benzodioxol-5-yl)-6-[10-[5-(1,3-benzodioxol-5-yl)-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-6-ium-6-yl]decyl]-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-6-ium diiodide
Also Known As: 1,3-Dioxolo(4,5-g)isoquinolinium, 6,6'-decamethylenebis(5,6,7,8-tetrahydro-6-methyl-5-(3,4-(methylenedioxy)phenyl)-, diiodide, 5-(1,3-benzodioxol-5-yl)-6-[10-[5-(1,3-benzodioxol-5-yl)-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-6-ium-6-yl]decyl]-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-6-ium diiodide, 1,3-DIOXOLO(4,5-g)ISOQUINOLINIUM, 6,6'-DECAMETHYLENEBIS(5,6,7,8-TETRAHYDRO-6-MET, RefChem:1052923
| Molecular Formula | C46H54I2N2O8 |
|---|---|
| Molecular Weight | 1016.20 g/mol |
| LogP | 2.61 |
| Topological Polar Surface Area | 73.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 13 |
| Exact Mass | 1016.19696 |
| Heavy Atoms | 58 |
| Complexity | 1210.0 |
Chemical Identifiers
| CAS Number | 20232-95-5 |
|---|---|
| SMILES | C[N+]1(CCC2=CC3=C(C=C2C1C4=CC5=C(C=C4)OCO5)OCO3)CCCCCCCCCC[N+]6(CCC7=CC8=C(C=C7C6C9=CC1=C(C=C9)OCO1)OCO8)C.[I-].[I-] |
| InChIKey | SRXVAIORCPKQJO-UHFFFAOYSA-L |
Product Overview
RefChem:1052923 (CAS 20232-95-5), with molecular formula C46H54I2N2O8 and molecular weight 1016.20 g/mol. IUPAC: 5-(1,3-benzodioxol-5-yl)-6-[10-[5-(1,3-benzodioxol-5-yl)-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-6-ium-6-yl]decyl]-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-6-ium diiodide.
Chemical Property Profile of RefChem:1052923
Property Insights of RefChem:1052923
The XLogP value of 2.61 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1052923. The TPSA of 73.8 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1052923. Following Lipinski's Rule of Five, RefChem:1052923 has 0 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:1052923?
The CAS number of RefChem:1052923 is 20232-95-5.
What is the molecular formula of RefChem:1052923?
The molecular formula of RefChem:1052923 is C46H54I2N2O8.
What is the molecular weight of RefChem:1052923?
The molecular weight of RefChem:1052923 is 1016.20 g/mol.
Where can I buy RefChem:1052923?
You can request a quote for RefChem:1052923 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1052923?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1052923 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.