4-(2-(1,3-Benzodioxol-5-yl)vinyl)quinoline
TL;DR: 4-(2-(1,3-Benzodioxol-5-yl)vinyl)quinoline (CAS 37483-63-9) is a chemical compound with molecular formula C18H13NO2 and molecular weight 275.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]quinoline
Also Known As: 4-(2-(1,3-Benzodioxol-5-yl)vinyl)quinoline, 4-[2-(1,3-benzodioxol-5-yl)ethenyl]quinoline, 4-(2-(Benzo[d][1,3]dioxol-5-yl)vinyl)quinoline, 4-(2-benzo[1,3]dioxol-5-ylethenyl)quinoline, 4-[2-(1,3-benzodioxol-5-yl)vinyl]quinoline
| Molecular Formula | C18H13NO2 |
|---|---|
| Molecular Weight | 275.09 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 31.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 275.09464 |
| Heavy Atoms | 21 |
| Complexity | 383.0 |
Chemical Identifiers
| CAS Number | 37483-63-9 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)/C=C/C3=CC=NC4=CC=CC=C34 |
| InChIKey | FHSFBUIJHLVPRQ-FNORWQNLSA-N |
Product Overview
4-(2-(1,3-Benzodioxol-5-yl)vinyl)quinoline (CAS 37483-63-9), with molecular formula C18H13NO2 and molecular weight 275.09 g/mol. IUPAC: 4-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]quinoline.
Chemical Property Profile of 4-(2-(1,3-Benzodioxol-5-yl)vinyl)quinoline
Property Insights of 4-(2-(1,3-Benzodioxol-5-yl)vinyl)quinoline
The XLogP value of 4.3 indicates that 4-(2-(1,3-Benzodioxol-5-yl)vinyl)quinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 31.4 Ų, 4-(2-(1,3-Benzodioxol-5-yl)vinyl)quinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(2-(1,3-Benzodioxol-5-yl)vinyl)quinoline has 0 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 4-(2-(1,3-Benzodioxol-5-yl)vinyl)quinoline?
The CAS number of 4-(2-(1,3-Benzodioxol-5-yl)vinyl)quinoline is 37483-63-9.
What is the molecular formula of 4-(2-(1,3-Benzodioxol-5-yl)vinyl)quinoline?
The molecular formula of 4-(2-(1,3-Benzodioxol-5-yl)vinyl)quinoline is C18H13NO2.
What is the molecular weight of 4-(2-(1,3-Benzodioxol-5-yl)vinyl)quinoline?
The molecular weight of 4-(2-(1,3-Benzodioxol-5-yl)vinyl)quinoline is 275.09 g/mol.
Where can I buy 4-(2-(1,3-Benzodioxol-5-yl)vinyl)quinoline?
You can request a quote for 4-(2-(1,3-Benzodioxol-5-yl)vinyl)quinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-(1,3-Benzodioxol-5-yl)vinyl)quinoline?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-(1,3-Benzodioxol-5-yl)vinyl)quinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.