2-(2-Quinolylthio)benzothiazole
TL;DR: 2-(2-Quinolylthio)benzothiazole (CAS 119993-80-5) is a chemical compound with molecular formula C16H10N2S2 and molecular weight 294.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-quinolin-2-ylsulfanyl-1,3-benzothiazole
Also Known As: 2-(Quinolin-2-ylthio)benzo[d]thiazole, 2-(2-QUINOLYLTHIO)BENZOTHIAZOLE, 2-benzothiazol-2-ylsulfanylquinoline, 2-quinolin-2-ylsulfanyl-1,3-benzothiazole, 2-(1,3-benzothiazol-2-ylsulfanyl)quinoline
| Molecular Formula | C16H10N2S2 |
|---|---|
| Molecular Weight | 294.03 g/mol |
| LogP | 4.9957 |
| Topological Polar Surface Area | 25.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 294.02853 |
| Heavy Atoms | 20 |
| Complexity | 865.91895 |
Chemical Identifiers
| CAS Number | 119993-80-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC(=N2)SC3=NC4=CC=CC=C4S3 |
Product Overview
2-(2-Quinolylthio)benzothiazole (CAS 119993-80-5), with molecular formula C16H10N2S2 and molecular weight 294.03 g/mol. IUPAC: 2-quinolin-2-ylsulfanyl-1,3-benzothiazole.
Chemical Property Profile of 2-(2-Quinolylthio)benzothiazole
Property Insights of 2-(2-Quinolylthio)benzothiazole
The XLogP value of 4.9957 indicates that 2-(2-Quinolylthio)benzothiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.78 Ų, 2-(2-Quinolylthio)benzothiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Quinolylthio)benzothiazole has 0 hydrogen bond donor(s) and 4 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-(2-Quinolylthio)benzothiazole?
The CAS number of 2-(2-Quinolylthio)benzothiazole is 119993-80-5.
What is the molecular formula of 2-(2-Quinolylthio)benzothiazole?
The molecular formula of 2-(2-Quinolylthio)benzothiazole is C16H10N2S2.
What is the molecular weight of 2-(2-Quinolylthio)benzothiazole?
The molecular weight of 2-(2-Quinolylthio)benzothiazole is 294.03 g/mol.
Where can I buy 2-(2-Quinolylthio)benzothiazole?
You can request a quote for 2-(2-Quinolylthio)benzothiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Quinolylthio)benzothiazole?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Quinolylthio)benzothiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.