4-((2E)-3-chlorobut-2-enyloxy)-8-bromo-2-methylquinoline
TL;DR: 4-((2E)-3-chlorobut-2-enyloxy)-8-bromo-2-methylquinoline (CAS 123452-87-9) is a chemical compound with molecular formula C14H13BrClNO and molecular weight 324.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-bromo-4-[(E)-3-chlorobut-2-enoxy]-2-methylquinoline
Also Known As: BAS 00218004, 8-bromo-2-methyl-4-quinolinyl 3-chloro-2-butenyl ether, 8-Bromo-4-(3-chloro-but-2-enyloxy)-2-methyl-quinoline, 8-bromo-4-[(E)-3-chlorobut-2-enoxy]-2-methylquinoline, 4-((2E)-3-chlorobut-2-enyloxy)-8-bromo-2-methylquinoline
| Molecular Formula | C14H13BrClNO |
|---|---|
| Molecular Weight | 324.99 g/mol |
| LogP | 4.82712 |
| Topological Polar Surface Area | 22.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 324.9869 |
| Heavy Atoms | 18 |
| Complexity | 606.0106 |
Chemical Identifiers
| CAS Number | 123452-87-9 |
|---|---|
| SMILES | CC1=CC(=C2C=CC=C(C2=N1)Br)OC/C=C(\C)/Cl |
Product Overview
4-((2E)-3-chlorobut-2-enyloxy)-8-bromo-2-methylquinoline (CAS 123452-87-9), with molecular formula C14H13BrClNO and molecular weight 324.99 g/mol. IUPAC: 8-bromo-4-[(E)-3-chlorobut-2-enoxy]-2-methylquinoline.
Chemical Property Profile of 4-((2E)-3-chlorobut-2-enyloxy)-8-bromo-2-methylquinoline
Property Insights of 4-((2E)-3-chlorobut-2-enyloxy)-8-bromo-2-methylquinoline
The XLogP value of 4.82712 indicates that 4-((2E)-3-chlorobut-2-enyloxy)-8-bromo-2-methylquinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 22.12 Ų, 4-((2E)-3-chlorobut-2-enyloxy)-8-bromo-2-methylquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-((2E)-3-chlorobut-2-enyloxy)-8-bromo-2-methylquinoline has 0 hydrogen bond donor(s) and 2 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-((2E)-3-chlorobut-2-enyloxy)-8-bromo-2-methylquinoline?
The CAS number of 4-((2E)-3-chlorobut-2-enyloxy)-8-bromo-2-methylquinoline is 123452-87-9.
What is the molecular formula of 4-((2E)-3-chlorobut-2-enyloxy)-8-bromo-2-methylquinoline?
The molecular formula of 4-((2E)-3-chlorobut-2-enyloxy)-8-bromo-2-methylquinoline is C14H13BrClNO.
What is the molecular weight of 4-((2E)-3-chlorobut-2-enyloxy)-8-bromo-2-methylquinoline?
The molecular weight of 4-((2E)-3-chlorobut-2-enyloxy)-8-bromo-2-methylquinoline is 324.99 g/mol.
Where can I buy 4-((2E)-3-chlorobut-2-enyloxy)-8-bromo-2-methylquinoline?
You can request a quote for 4-((2E)-3-chlorobut-2-enyloxy)-8-bromo-2-methylquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-((2E)-3-chlorobut-2-enyloxy)-8-bromo-2-methylquinoline?
Yes, KEHONG BIO provides custom synthesis services for 4-((2E)-3-chlorobut-2-enyloxy)-8-bromo-2-methylquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.