![Methyl [(6-chloro-2-oxo-4-phenyl-1,2-dihydroquinolin-3-yl)thio]acetate structure](/static/products/525/525581-69-5.png)
Methyl [(6-chloro-2-oxo-4-phenyl-1,2-dihydroquinolin-3-yl)thio]acetate
TL;DR: Methyl [(6-chloro-2-oxo-4-phenyl-1,2-dihydroquinolin-3-yl)thio]acetate (CAS 525581-69-5) is a chemical compound with molecular formula C18H14ClNO3S and molecular weight 359.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)sulfanyl]acetate
Also Known As: ChemDiv3_004454, IDI1_022364, BRD-K99021941-001-01-3, methyl 2-[(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)sulfanyl]acetate, methyl [(6-chloro-2-oxo-4-phenyl-1,2-dihydroquinolin-3-yl)thio]acetate
| Molecular Formula | C18H14ClNO3S |
|---|---|
| Molecular Weight | 359.04 g/mol |
| LogP | 4.1136 |
| Topological Polar Surface Area | 59.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 359.0383 |
| Heavy Atoms | 24 |
| Complexity | 953.63025 |
Chemical Identifiers
| CAS Number | 525581-69-5 |
|---|---|
| SMILES | COC(=O)CSC1=C(C2=C(C=CC(=C2)Cl)NC1=O)C3=CC=CC=C3 |
Product Overview
Methyl [(6-chloro-2-oxo-4-phenyl-1,2-dihydroquinolin-3-yl)thio]acetate (CAS 525581-69-5), with molecular formula C18H14ClNO3S and molecular weight 359.04 g/mol. IUPAC: methyl 2-[(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)sulfanyl]acetate.
Chemical Property Profile of Methyl [(6-chloro-2-oxo-4-phenyl-1,2-dihydroquinolin-3-yl)thio]acetate
Property Insights of Methyl [(6-chloro-2-oxo-4-phenyl-1,2-dihydroquinolin-3-yl)thio]acetate
The XLogP value of 4.1136 indicates that Methyl [(6-chloro-2-oxo-4-phenyl-1,2-dihydroquinolin-3-yl)thio]acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.16 Ų, Methyl [(6-chloro-2-oxo-4-phenyl-1,2-dihydroquinolin-3-yl)thio]acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl [(6-chloro-2-oxo-4-phenyl-1,2-dihydroquinolin-3-yl)thio]acetate has 1 hydrogen bond donor(s) and 4 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 Methyl [(6-chloro-2-oxo-4-phenyl-1,2-dihydroquinolin-3-yl)thio]acetate?
The CAS number of Methyl [(6-chloro-2-oxo-4-phenyl-1,2-dihydroquinolin-3-yl)thio]acetate is 525581-69-5.
What is the molecular formula of Methyl [(6-chloro-2-oxo-4-phenyl-1,2-dihydroquinolin-3-yl)thio]acetate?
The molecular formula of Methyl [(6-chloro-2-oxo-4-phenyl-1,2-dihydroquinolin-3-yl)thio]acetate is C18H14ClNO3S.
What is the molecular weight of Methyl [(6-chloro-2-oxo-4-phenyl-1,2-dihydroquinolin-3-yl)thio]acetate?
The molecular weight of Methyl [(6-chloro-2-oxo-4-phenyl-1,2-dihydroquinolin-3-yl)thio]acetate is 359.04 g/mol.
Where can I buy Methyl [(6-chloro-2-oxo-4-phenyl-1,2-dihydroquinolin-3-yl)thio]acetate?
You can request a quote for Methyl [(6-chloro-2-oxo-4-phenyl-1,2-dihydroquinolin-3-yl)thio]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl [(6-chloro-2-oxo-4-phenyl-1,2-dihydroquinolin-3-yl)thio]acetate?
Yes, KEHONG BIO provides custom synthesis services for Methyl [(6-chloro-2-oxo-4-phenyl-1,2-dihydroquinolin-3-yl)thio]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.