![[(2-Methylsulfanylquinolin-3-yl)methylideneamino] 3,4-dichlorobenzoate structure](/static/products/6729/672950-49-1.webp)
[(2-Methylsulfanylquinolin-3-yl)methylideneamino] 3,4-dichlorobenzoate
TL;DR: [(2-Methylsulfanylquinolin-3-yl)methylideneamino] 3,4-dichlorobenzoate (CAS 672950-49-1) is a chemical compound with molecular formula C18H12Cl2N2O2S and molecular weight 390.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2-methylsulfanylquinolin-3-yl)methylideneamino] 3,4-dichlorobenzoate
Also Known As: Bionet1_004475, [(2-methylsulfanylquinolin-3-yl)methylideneamino] 3,4-dichlorobenzoate, 3-({[(3,4-dichlorobenzoyl)oxy]imino}methyl)-2-(methylsulfanyl)quinoline
| Molecular Formula | C18H12Cl2N2O2S |
|---|---|
| Molecular Weight | 390.00 g/mol |
| LogP | 5.4544 |
| Topological Polar Surface Area | 51.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 389.99966 |
| Heavy Atoms | 25 |
| Complexity | 976.4473 |
Chemical Identifiers
| CAS Number | 672950-49-1 |
|---|---|
| SMILES | CSC1=NC2=CC=CC=C2C=C1C=NOC(=O)C3=CC(=C(C=C3)Cl)Cl |
Product Overview
[(2-Methylsulfanylquinolin-3-yl)methylideneamino] 3,4-dichlorobenzoate (CAS 672950-49-1), with molecular formula C18H12Cl2N2O2S and molecular weight 390.00 g/mol. IUPAC: [(2-methylsulfanylquinolin-3-yl)methylideneamino] 3,4-dichlorobenzoate.
Chemical Property Profile of [(2-Methylsulfanylquinolin-3-yl)methylideneamino] 3,4-dichlorobenzoate
Property Insights of [(2-Methylsulfanylquinolin-3-yl)methylideneamino] 3,4-dichlorobenzoate
The XLogP value of 5.4544 indicates that [(2-Methylsulfanylquinolin-3-yl)methylideneamino] 3,4-dichlorobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.55 Ų, [(2-Methylsulfanylquinolin-3-yl)methylideneamino] 3,4-dichlorobenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [(2-Methylsulfanylquinolin-3-yl)methylideneamino] 3,4-dichlorobenzoate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of [(2-Methylsulfanylquinolin-3-yl)methylideneamino] 3,4-dichlorobenzoate?
The CAS number of [(2-Methylsulfanylquinolin-3-yl)methylideneamino] 3,4-dichlorobenzoate is 672950-49-1.
What is the molecular formula of [(2-Methylsulfanylquinolin-3-yl)methylideneamino] 3,4-dichlorobenzoate?
The molecular formula of [(2-Methylsulfanylquinolin-3-yl)methylideneamino] 3,4-dichlorobenzoate is C18H12Cl2N2O2S.
What is the molecular weight of [(2-Methylsulfanylquinolin-3-yl)methylideneamino] 3,4-dichlorobenzoate?
The molecular weight of [(2-Methylsulfanylquinolin-3-yl)methylideneamino] 3,4-dichlorobenzoate is 390.00 g/mol.
Where can I buy [(2-Methylsulfanylquinolin-3-yl)methylideneamino] 3,4-dichlorobenzoate?
You can request a quote for [(2-Methylsulfanylquinolin-3-yl)methylideneamino] 3,4-dichlorobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(2-Methylsulfanylquinolin-3-yl)methylideneamino] 3,4-dichlorobenzoate?
Yes, KEHONG BIO provides custom synthesis services for [(2-Methylsulfanylquinolin-3-yl)methylideneamino] 3,4-dichlorobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.