3-(3-Chlorobut-2-EN-1-YL)-2-methylquinolin-4-OL
TL;DR: 3-(3-Chlorobut-2-EN-1-YL)-2-methylquinolin-4-OL (CAS 88654-98-2) is a chemical compound with molecular formula C14H14ClNO and molecular weight 247.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(E)-3-chlorobut-2-enyl]-2-methyl-1H-quinolin-4-one
Also Known As: 3-(3-CHLOROBUT-2-EN-1-YL)-2-METHYLQUINOLIN-4-OL
| Molecular Formula | C14H14ClNO |
|---|---|
| Molecular Weight | 247.08 g/mol |
| LogP | 3.52162 |
| Topological Polar Surface Area | 32.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 247.07639 |
| Heavy Atoms | 17 |
| Complexity | 636.2025 |
Chemical Identifiers
| CAS Number | 88654-98-2 |
|---|---|
| SMILES | CC1=C(C(=O)C2=CC=CC=C2N1)C/C=C(\C)/Cl |
Product Overview
3-(3-Chlorobut-2-EN-1-YL)-2-methylquinolin-4-OL (CAS 88654-98-2), with molecular formula C14H14ClNO and molecular weight 247.08 g/mol. IUPAC: 3-[(E)-3-chlorobut-2-enyl]-2-methyl-1H-quinolin-4-one.
Chemical Property Profile of 3-(3-Chlorobut-2-EN-1-YL)-2-methylquinolin-4-OL
Property Insights of 3-(3-Chlorobut-2-EN-1-YL)-2-methylquinolin-4-OL
The XLogP value of 3.52162 indicates that 3-(3-Chlorobut-2-EN-1-YL)-2-methylquinolin-4-OL is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.86 Ų, 3-(3-Chlorobut-2-EN-1-YL)-2-methylquinolin-4-OL exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(3-Chlorobut-2-EN-1-YL)-2-methylquinolin-4-OL has 1 hydrogen bond donor(s) and 1 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 3-(3-Chlorobut-2-EN-1-YL)-2-methylquinolin-4-OL?
The CAS number of 3-(3-Chlorobut-2-EN-1-YL)-2-methylquinolin-4-OL is 88654-98-2.
What is the molecular formula of 3-(3-Chlorobut-2-EN-1-YL)-2-methylquinolin-4-OL?
The molecular formula of 3-(3-Chlorobut-2-EN-1-YL)-2-methylquinolin-4-OL is C14H14ClNO.
What is the molecular weight of 3-(3-Chlorobut-2-EN-1-YL)-2-methylquinolin-4-OL?
The molecular weight of 3-(3-Chlorobut-2-EN-1-YL)-2-methylquinolin-4-OL is 247.08 g/mol.
Where can I buy 3-(3-Chlorobut-2-EN-1-YL)-2-methylquinolin-4-OL?
You can request a quote for 3-(3-Chlorobut-2-EN-1-YL)-2-methylquinolin-4-OL directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3-Chlorobut-2-EN-1-YL)-2-methylquinolin-4-OL?
Yes, KEHONG BIO provides custom synthesis services for 3-(3-Chlorobut-2-EN-1-YL)-2-methylquinolin-4-OL and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.