RefChem:219042
TL;DR: RefChem:219042 (CAS 17606-09-6) is a chemical compound with molecular formula C19H22ClNO4 and molecular weight 363.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-methoxyphenyl)-(6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)methanol;hydrochloride
Also Known As: 1,3-Dioxolo(4,5-g)isoquinoline-5-methanol, 5,6,7,8-tetrahydro-alpha-(p-methoxyphenyl)-6-methyl-, hydrochloride, (4-Methoxyphenyl)(6-methyl-5,6,7,8-tetrahydro-2H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)methanol--hydrogen chloride (1/1), (4-methoxyphenyl)-(6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)methanol hydrochloride, RefChem:219042
| Molecular Formula | C19H22ClNO4 |
|---|---|
| Molecular Weight | 363.12 g/mol |
| LogP | 3.1083 |
| Topological Polar Surface Area | 51.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 363.12375 |
| Heavy Atoms | 25 |
| Complexity | 426.0 |
Chemical Identifiers
| CAS Number | 17606-09-6 |
|---|---|
| SMILES | CN1CCC2=CC3=C(C=C2C1C(C4=CC=C(C=C4)OC)O)OCO3.Cl |
| InChIKey | ZVEKXQFHAXGMDU-UHFFFAOYSA-N |
Product Overview
RefChem:219042 (CAS 17606-09-6), with molecular formula C19H22ClNO4 and molecular weight 363.12 g/mol. IUPAC: (4-methoxyphenyl)-(6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)methanol;hydrochloride.
Chemical Property Profile of RefChem:219042
Property Insights of RefChem:219042
The XLogP value of 3.1083 indicates that RefChem:219042 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.2 Ų, RefChem:219042 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:219042 has 2 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 RefChem:219042?
The CAS number of RefChem:219042 is 17606-09-6.
What is the molecular formula of RefChem:219042?
The molecular formula of RefChem:219042 is C19H22ClNO4.
What is the molecular weight of RefChem:219042?
The molecular weight of RefChem:219042 is 363.12 g/mol.
Where can I buy RefChem:219042?
You can request a quote for RefChem:219042 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:219042?
Yes, KEHONG BIO provides custom synthesis services for RefChem:219042 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.