8-Benzothiazol-2-ylthio-5-quinolylamine
TL;DR: 8-Benzothiazol-2-ylthio-5-quinolylamine (CAS 38533-63-0) is a chemical compound with molecular formula C16H11N3S2 and molecular weight 309.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-(1,3-benzothiazol-2-ylsulfanyl)quinolin-5-amine
Also Known As: 8-Benzothiazol-2-ylthio-5-quinolylamine, 8-(2-Benzothiazolylthio)-5-quinolinamine, 5-Amino-8-quinolyl-(2'-benzothiazolyl)sulfide, 8-(1,3-benzothiazol-2-ylsulfanyl)quinolin-5-amine, 8-[(1,3-Benzothiazol-2-yl)sulfanyl]quinolin-5-amine
| Molecular Formula | C16H11N3S2 |
|---|---|
| Molecular Weight | 309.04 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 105.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 309.03943 |
| Heavy Atoms | 21 |
| Complexity | 367.0 |
Chemical Identifiers
| CAS Number | 38533-63-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(S2)SC3=C4C(=C(C=C3)N)C=CC=N4 |
| InChIKey | DQLGLDMAHYTTTM-UHFFFAOYSA-N |
Product Overview
8-Benzothiazol-2-ylthio-5-quinolylamine (CAS 38533-63-0), with molecular formula C16H11N3S2 and molecular weight 309.04 g/mol. IUPAC: 8-(1,3-benzothiazol-2-ylsulfanyl)quinolin-5-amine.
Chemical Property Profile of 8-Benzothiazol-2-ylthio-5-quinolylamine
Property Insights of 8-Benzothiazol-2-ylthio-5-quinolylamine
The XLogP value of 4.4 indicates that 8-Benzothiazol-2-ylthio-5-quinolylamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-Benzothiazol-2-ylthio-5-quinolylamine. Following Lipinski's Rule of Five, 8-Benzothiazol-2-ylthio-5-quinolylamine has 1 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 8-Benzothiazol-2-ylthio-5-quinolylamine?
The CAS number of 8-Benzothiazol-2-ylthio-5-quinolylamine is 38533-63-0.
What is the molecular formula of 8-Benzothiazol-2-ylthio-5-quinolylamine?
The molecular formula of 8-Benzothiazol-2-ylthio-5-quinolylamine is C16H11N3S2.
What is the molecular weight of 8-Benzothiazol-2-ylthio-5-quinolylamine?
The molecular weight of 8-Benzothiazol-2-ylthio-5-quinolylamine is 309.04 g/mol.
Where can I buy 8-Benzothiazol-2-ylthio-5-quinolylamine?
You can request a quote for 8-Benzothiazol-2-ylthio-5-quinolylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-Benzothiazol-2-ylthio-5-quinolylamine?
Yes, KEHONG BIO provides custom synthesis services for 8-Benzothiazol-2-ylthio-5-quinolylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.