1,3-Dioxolo(4,5-g)isoquinoline, 7-veratryl-
TL;DR: 1,3-Dioxolo(4,5-g)isoquinoline, 7-veratryl- (CAS 20232-48-8) is a chemical compound with molecular formula C19H17NO4 and molecular weight 323.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[(3,4-dimethoxyphenyl)methyl]-[1,3]dioxolo[4,5-g]isoquinoline
Also Known As: 1,3-DIOXOLO(4,5-g)ISOQUINOLINE, 7-VERATRYL-, 7-Veratryl-1,3-dioxolo(4,5-g)isoquinoline, 2-27-00-00561 (Beilstein Handbook Reference), 7-[(3,4-dimethoxyphenyl)methyl]-[1,3]dioxolo[4,5-g]isoquinoline, 7-[(3,4-DIMETHOXYPHENYL)METHYL]-2H-[1,3]DIOXOLO[4,5-G]ISOQUINOLINE
| Molecular Formula | C19H17NO4 |
|---|---|
| Molecular Weight | 323.12 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 49.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 323.11575 |
| Heavy Atoms | 24 |
| Complexity | 420.0 |
Chemical Identifiers
| CAS Number | 20232-48-8 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CC2=NC=C3C=C4C(=CC3=C2)OCO4)OC |
| InChIKey | KKKZZWQLQNTAQB-UHFFFAOYSA-N |
Product Overview
1,3-Dioxolo(4,5-g)isoquinoline, 7-veratryl- (CAS 20232-48-8), with molecular formula C19H17NO4 and molecular weight 323.12 g/mol. IUPAC: 7-[(3,4-dimethoxyphenyl)methyl]-[1,3]dioxolo[4,5-g]isoquinoline.
Chemical Property Profile of 1,3-Dioxolo(4,5-g)isoquinoline, 7-veratryl-
Property Insights of 1,3-Dioxolo(4,5-g)isoquinoline, 7-veratryl-
The XLogP value of 3.8 indicates that 1,3-Dioxolo(4,5-g)isoquinoline, 7-veratryl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.8 Ų, 1,3-Dioxolo(4,5-g)isoquinoline, 7-veratryl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Dioxolo(4,5-g)isoquinoline, 7-veratryl- has 0 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 1,3-Dioxolo(4,5-g)isoquinoline, 7-veratryl-?
The CAS number of 1,3-Dioxolo(4,5-g)isoquinoline, 7-veratryl- is 20232-48-8.
What is the molecular formula of 1,3-Dioxolo(4,5-g)isoquinoline, 7-veratryl-?
The molecular formula of 1,3-Dioxolo(4,5-g)isoquinoline, 7-veratryl- is C19H17NO4.
What is the molecular weight of 1,3-Dioxolo(4,5-g)isoquinoline, 7-veratryl-?
The molecular weight of 1,3-Dioxolo(4,5-g)isoquinoline, 7-veratryl- is 323.12 g/mol.
Where can I buy 1,3-Dioxolo(4,5-g)isoquinoline, 7-veratryl-?
You can request a quote for 1,3-Dioxolo(4,5-g)isoquinoline, 7-veratryl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dioxolo(4,5-g)isoquinoline, 7-veratryl-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dioxolo(4,5-g)isoquinoline, 7-veratryl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.