RefChem:219034
TL;DR: RefChem:219034 (CAS 16974-20-2) is a chemical compound with molecular formula C19H24ClNO2 and molecular weight 333.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-methyl-5-[(1-methylcyclohexyl)methyl]-[1,3]dioxolo[4,5-g]isoquinolin-6-ium chloride
Also Known As: 1,3-Dioxolo(4,5-g)isoquinoline, 7-methyl-5-((1-methylcyclohexyl)methyl)-, hydrochloride, 7-Methyl-5-((1-methylcyclohexyl)methyl)-1,3-dioxolo(4,5-g)isoquinoline hydrochloride, 7-methyl-5-[(1-methylcyclohexyl)methyl]-[1,3]dioxolo[4,5-g]isoquinolin-6-ium chloride, RefChem:219034
| Molecular Formula | C19H24ClNO2 |
|---|---|
| Molecular Weight | 333.15 g/mol |
| LogP | 1.21 |
| Topological Polar Surface Area | 32.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 333.14957 |
| Heavy Atoms | 23 |
| Complexity | 393.0 |
Chemical Identifiers
| CAS Number | 16974-20-2 |
|---|---|
| SMILES | CC1=CC2=CC3=C(C=C2C(=[NH+]1)CC4(CCCCC4)C)OCO3.[Cl-] |
| InChIKey | MYRQVNIFBMWJEH-UHFFFAOYSA-N |
Product Overview
RefChem:219034 (CAS 16974-20-2), with molecular formula C19H24ClNO2 and molecular weight 333.15 g/mol. IUPAC: 7-methyl-5-[(1-methylcyclohexyl)methyl]-[1,3]dioxolo[4,5-g]isoquinolin-6-ium chloride.
Chemical Property Profile of RefChem:219034
Property Insights of RefChem:219034
The XLogP value of 1.21 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:219034. With a topological polar surface area (TPSA) of 32.6 Ų, RefChem:219034 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:219034 has 1 hydrogen bond donor(s) and 3 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 RefChem:219034?
The CAS number of RefChem:219034 is 16974-20-2.
What is the molecular formula of RefChem:219034?
The molecular formula of RefChem:219034 is C19H24ClNO2.
What is the molecular weight of RefChem:219034?
The molecular weight of RefChem:219034 is 333.15 g/mol.
Where can I buy RefChem:219034?
You can request a quote for RefChem:219034 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:219034?
Yes, KEHONG BIO provides custom synthesis services for RefChem:219034 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.