RefChem:340489
TL;DR: RefChem:340489 (CAS 5375-23-5) is a chemical compound with molecular formula C17H23ClN2O4S2 and molecular weight 418.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-4-methyl-2-[5-(2-sulfosulfanylethylamino)pentoxy]quinoline
Also Known As: S-2-((5-(6-Chloro-4-methyl-2-quinolyloxy)pentyl)amino)ethyl hydrogen thiosulfate, Ethanethiosulfuric acid, 2-(5-(6-chloro-4-methyl-2-quinolyloxy)pentyl)amino-, Thiosulfuric acid, S-(2-((5-(6-chloro-4-methyl-2-quinolyloxy)pentyl)amino)ethyl) ester, Ethanethiol, 2-(5-(6-chloro-4-methyl-2-quinolyloxy)pentyl)amino-, hydrogen sulfate (ester), s-[2-({5-[(6-chloro-4-methylquinolin-2-yl)oxy]pentyl}amino)ethyl] hydrogen sulfurothioate
| Molecular Formula | C17H23ClN2O4S2 |
|---|---|
| Molecular Weight | 418.08 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 122.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 418.07877 |
| Heavy Atoms | 26 |
| Complexity | 503.0 |
Chemical Identifiers
| CAS Number | 5375-23-5 |
|---|---|
| SMILES | CC1=CC(=NC2=C1C=C(C=C2)Cl)OCCCCCNCCSS(=O)(=O)O |
| InChIKey | HKIZCIYTMMHSCB-UHFFFAOYSA-N |
Product Overview
RefChem:340489 (CAS 5375-23-5), with molecular formula C17H23ClN2O4S2 and molecular weight 418.08 g/mol. IUPAC: 6-chloro-4-methyl-2-[5-(2-sulfosulfanylethylamino)pentoxy]quinoline.
Chemical Property Profile of RefChem:340489
Property Insights of RefChem:340489
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:340489. The TPSA of 122.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:340489. Following Lipinski's Rule of Five, RefChem:340489 has 2 hydrogen bond donor(s) and 7 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 RefChem:340489?
The CAS number of RefChem:340489 is 5375-23-5.
What is the molecular formula of RefChem:340489?
The molecular formula of RefChem:340489 is C17H23ClN2O4S2.
What is the molecular weight of RefChem:340489?
The molecular weight of RefChem:340489 is 418.08 g/mol.
Where can I buy RefChem:340489?
You can request a quote for RefChem:340489 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:340489?
Yes, KEHONG BIO provides custom synthesis services for RefChem:340489 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.