RefChem:350019
TL;DR: RefChem:350019 (CAS 73168-81-7) is a chemical compound with molecular formula C20H23ClINO4 and molecular weight 503.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2-iodo-4,5-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydroisoquinolin-2-ium chloride
Also Known As: 6'-Iodo-dihydropapaverine hydrochloride, 3,4-Dihydro-6,7-dimethoxy-1-((4,5-dimethoxy-2-iodo)benzyl)isoquinoline hydrochloride, Isoquinoline, 3,4-dihydro-6,7-dimethoxy-1-((2-iodo-4,5-dimethoxyphenyl)methyl)-, HCl, Isoquinoline, 3,4-dihydro-6,7-dimethoxy-1-((4,5-dimethoxy-2-iodo)benzyl)-, hydrochloride, 1-[(2-iodo-4,5-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydroisoquinolin-2-ium chloride
| Molecular Formula | C20H23ClINO4 |
|---|---|
| Molecular Weight | 503.04 g/mol |
| LogP | -1.0 |
| Topological Polar Surface Area | 50.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 503.03604 |
| Heavy Atoms | 27 |
| Complexity | 488.0 |
Chemical Identifiers
| CAS Number | 73168-81-7 |
|---|---|
| SMILES | COC1=C(C=C2C(=C1)CC[NH+]=C2CC3=CC(=C(C=C3I)OC)OC)OC.[Cl-] |
| InChIKey | UUHUIXBEOPRXIX-UHFFFAOYSA-N |
Product Overview
RefChem:350019 (CAS 73168-81-7), with molecular formula C20H23ClINO4 and molecular weight 503.04 g/mol. IUPAC: 1-[(2-iodo-4,5-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydroisoquinolin-2-ium chloride.
Chemical Property Profile of RefChem:350019
Property Insights of RefChem:350019
The XLogP value of -1.0 indicates that RefChem:350019 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 50.9 Ų, RefChem:350019 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:350019 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:350019?
The CAS number of RefChem:350019 is 73168-81-7.
What is the molecular formula of RefChem:350019?
The molecular formula of RefChem:350019 is C20H23ClINO4.
What is the molecular weight of RefChem:350019?
The molecular weight of RefChem:350019 is 503.04 g/mol.
Where can I buy RefChem:350019?
You can request a quote for RefChem:350019 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:350019?
Yes, KEHONG BIO provides custom synthesis services for RefChem:350019 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.