Piperidinium, 1-(2-((7-chloro-3,4-dihydro-4-oxo-3-phenyl-2-quinazolinyl)thio)ethyl)-1-methyl-,iodide
TL;DR: Piperidinium, 1-(2-((7-chloro-3,4-dihydro-4-oxo-3-phenyl-2-quinazolinyl)thio)ethyl)-1-methyl-,iodide (CAS 15641-55-1) is a chemical compound with molecular formula C22H25ClIN3OS and molecular weight 541.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-chloro-2-[2-(1-methylpiperidin-1-ium-1-yl)ethylsulfanyl]-3-phenylquinazolin-4-one iodide
Also Known As: Piperidinium, 1-(2-((7-chloro-3,4-dihydro-4-oxo-3-phenyl-2-quinazolinyl)thio)ethyl)-1-methyl-,iodide, 7-chloro-2-[2-(1-methylpiperidin-1-ium-1-yl)ethylsulfanyl]-3-phenylquinazolin-4-one iodide, 1-{2-[(7-Chloro-4-oxo-3-phenyl-3,4-dihydroquinazolin-2-yl)sulfanyl]ethyl}-1-methylpiperidin-1-ium iodide, RefChem:373390
| Molecular Formula | C22H25ClIN3OS |
|---|---|
| Molecular Weight | 541.05 g/mol |
| LogP | 1.7657 |
| Topological Polar Surface Area | 58.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 541.04517 |
| Heavy Atoms | 29 |
| Complexity | 586.0 |
Chemical Identifiers
| CAS Number | 15641-55-1 |
|---|---|
| SMILES | C[N+]1(CCCCC1)CCSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2C4=CC=CC=C4.[I-] |
| InChIKey | KSUQJIITRRYURI-UHFFFAOYSA-M |
Product Overview
Piperidinium, 1-(2-((7-chloro-3,4-dihydro-4-oxo-3-phenyl-2-quinazolinyl)thio)ethyl)-1-methyl-,iodide (CAS 15641-55-1), with molecular formula C22H25ClIN3OS and molecular weight 541.05 g/mol. IUPAC: 7-chloro-2-[2-(1-methylpiperidin-1-ium-1-yl)ethylsulfanyl]-3-phenylquinazolin-4-one iodide.
Chemical Property Profile of Piperidinium, 1-(2-((7-chloro-3,4-dihydro-4-oxo-3-phenyl-2-quinazolinyl)thio)ethyl)-1-methyl-,iodide
Property Insights of Piperidinium, 1-(2-((7-chloro-3,4-dihydro-4-oxo-3-phenyl-2-quinazolinyl)thio)ethyl)-1-methyl-,iodide
The XLogP value of 1.7657 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Piperidinium, 1-(2-((7-chloro-3,4-dihydro-4-oxo-3-phenyl-2-quinazolinyl)thio)ethyl)-1-methyl-,iodide. With a topological polar surface area (TPSA) of 58.0 Ų, Piperidinium, 1-(2-((7-chloro-3,4-dihydro-4-oxo-3-phenyl-2-quinazolinyl)thio)ethyl)-1-methyl-,iodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Piperidinium, 1-(2-((7-chloro-3,4-dihydro-4-oxo-3-phenyl-2-quinazolinyl)thio)ethyl)-1-methyl-,iodide has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Piperidinium, 1-(2-((7-chloro-3,4-dihydro-4-oxo-3-phenyl-2-quinazolinyl)thio)ethyl)-1-methyl-,iodide?
The CAS number of Piperidinium, 1-(2-((7-chloro-3,4-dihydro-4-oxo-3-phenyl-2-quinazolinyl)thio)ethyl)-1-methyl-,iodide is 15641-55-1.
What is the molecular formula of Piperidinium, 1-(2-((7-chloro-3,4-dihydro-4-oxo-3-phenyl-2-quinazolinyl)thio)ethyl)-1-methyl-,iodide?
The molecular formula of Piperidinium, 1-(2-((7-chloro-3,4-dihydro-4-oxo-3-phenyl-2-quinazolinyl)thio)ethyl)-1-methyl-,iodide is C22H25ClIN3OS.
What is the molecular weight of Piperidinium, 1-(2-((7-chloro-3,4-dihydro-4-oxo-3-phenyl-2-quinazolinyl)thio)ethyl)-1-methyl-,iodide?
The molecular weight of Piperidinium, 1-(2-((7-chloro-3,4-dihydro-4-oxo-3-phenyl-2-quinazolinyl)thio)ethyl)-1-methyl-,iodide is 541.05 g/mol.
Where can I buy Piperidinium, 1-(2-((7-chloro-3,4-dihydro-4-oxo-3-phenyl-2-quinazolinyl)thio)ethyl)-1-methyl-,iodide?
You can request a quote for Piperidinium, 1-(2-((7-chloro-3,4-dihydro-4-oxo-3-phenyl-2-quinazolinyl)thio)ethyl)-1-methyl-,iodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Piperidinium, 1-(2-((7-chloro-3,4-dihydro-4-oxo-3-phenyl-2-quinazolinyl)thio)ethyl)-1-methyl-,iodide?
Yes, KEHONG BIO provides custom synthesis services for Piperidinium, 1-(2-((7-chloro-3,4-dihydro-4-oxo-3-phenyl-2-quinazolinyl)thio)ethyl)-1-methyl-,iodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.