2-Chloro-3-((dimethylamino)methylene)-3,4-dihydro-1-methyl-4-phenylquinolinium methyl sulfate
TL;DR: 2-Chloro-3-((dimethylamino)methylene)-3,4-dihydro-1-methyl-4-phenylquinolinium methyl sulfate (CAS 75723-06-7) is a chemical compound with molecular formula C20H23ClN2O4S and molecular weight 422.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-chloro-1-methyl-4-phenyl-4H-quinolin-3-yl)methylidene-dimethylazanium;methyl sulfate
Also Known As: 2-Chloro-3-((dimethylamino)methylene)-3,4-dihydro-1-methyl-4-phenylquinolinium methyl sulfate, Quinolinium, 3,4-dihydro-2-chloro-3-((dimethylamino)methylene)-1-methyl-4-phenyl-, methyl sulfate, (2-chloro-1-methyl-4-phenyl-4H-quinolin-3-yl)methylidene-dimethylazanium; methyl sulfate, RefChem:378768
| Molecular Formula | C20H23ClN2O4S |
|---|---|
| Molecular Weight | 422.11 g/mol |
| LogP | 3.1546 |
| Topological Polar Surface Area | 72.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 422.10672 |
| Heavy Atoms | 28 |
| Complexity | 984.2751 |
Chemical Identifiers
| CAS Number | 75723-06-7 |
|---|---|
| SMILES | CN1C2=CC=CC=C2C(C(=C1Cl)C=[N+](C)C)C3=CC=CC=C3.COS(=O)(=O)[O-] |
Product Overview
2-Chloro-3-((dimethylamino)methylene)-3,4-dihydro-1-methyl-4-phenylquinolinium methyl sulfate (CAS 75723-06-7), with molecular formula C20H23ClN2O4S and molecular weight 422.11 g/mol. IUPAC: (2-chloro-1-methyl-4-phenyl-4H-quinolin-3-yl)methylidene-dimethylazanium;methyl sulfate.
Chemical Property Profile of 2-Chloro-3-((dimethylamino)methylene)-3,4-dihydro-1-methyl-4-phenylquinolinium methyl sulfate
Property Insights of 2-Chloro-3-((dimethylamino)methylene)-3,4-dihydro-1-methyl-4-phenylquinolinium methyl sulfate
The XLogP value of 3.1546 indicates that 2-Chloro-3-((dimethylamino)methylene)-3,4-dihydro-1-methyl-4-phenylquinolinium methyl sulfate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Chloro-3-((dimethylamino)methylene)-3,4-dihydro-1-methyl-4-phenylquinolinium methyl sulfate. Following Lipinski's Rule of Five, 2-Chloro-3-((dimethylamino)methylene)-3,4-dihydro-1-methyl-4-phenylquinolinium methyl sulfate has 0 hydrogen bond donor(s) and 5 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 2-Chloro-3-((dimethylamino)methylene)-3,4-dihydro-1-methyl-4-phenylquinolinium methyl sulfate?
The CAS number of 2-Chloro-3-((dimethylamino)methylene)-3,4-dihydro-1-methyl-4-phenylquinolinium methyl sulfate is 75723-06-7.
What is the molecular formula of 2-Chloro-3-((dimethylamino)methylene)-3,4-dihydro-1-methyl-4-phenylquinolinium methyl sulfate?
The molecular formula of 2-Chloro-3-((dimethylamino)methylene)-3,4-dihydro-1-methyl-4-phenylquinolinium methyl sulfate is C20H23ClN2O4S.
What is the molecular weight of 2-Chloro-3-((dimethylamino)methylene)-3,4-dihydro-1-methyl-4-phenylquinolinium methyl sulfate?
The molecular weight of 2-Chloro-3-((dimethylamino)methylene)-3,4-dihydro-1-methyl-4-phenylquinolinium methyl sulfate is 422.11 g/mol.
Where can I buy 2-Chloro-3-((dimethylamino)methylene)-3,4-dihydro-1-methyl-4-phenylquinolinium methyl sulfate?
You can request a quote for 2-Chloro-3-((dimethylamino)methylene)-3,4-dihydro-1-methyl-4-phenylquinolinium methyl sulfate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-3-((dimethylamino)methylene)-3,4-dihydro-1-methyl-4-phenylquinolinium methyl sulfate?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-3-((dimethylamino)methylene)-3,4-dihydro-1-methyl-4-phenylquinolinium methyl sulfate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.