S-(2-phenylquinolin-3-yl) benzenecarbothioate
TL;DR: S-(2-phenylquinolin-3-yl) benzenecarbothioate (CAS 646450-27-3) is a chemical compound with molecular formula C22H15NOS and molecular weight 341.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-(2-phenylquinolin-3-yl) benzenecarbothioate
Also Known As: S-(2-Phenylquinolin-3-yl) benzothioate, Pentadecanoic acid,3-amino-14-methyl, S-(2-phenylquinolin-3-yl) benzenecarbothioate, Benzenecarbothioic acid, S-(2-phenyl-3-quinolinyl) ester, Phenyl-(2-phenylquinolin-3-yl)sulfanyl-methanone
| Molecular Formula | C22H15NOS |
|---|---|
| Molecular Weight | 341.09 g/mol |
| LogP | 5.8343 |
| Topological Polar Surface Area | 29.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 341.08743 |
| Heavy Atoms | 25 |
| Complexity | 1029.5184 |
Chemical Identifiers
| CAS Number | 646450-27-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NC3=CC=CC=C3C=C2SC(=O)C4=CC=CC=C4 |
Product Overview
S-(2-phenylquinolin-3-yl) benzenecarbothioate (CAS 646450-27-3), with molecular formula C22H15NOS and molecular weight 341.09 g/mol. IUPAC: S-(2-phenylquinolin-3-yl) benzenecarbothioate.
Chemical Property Profile of S-(2-phenylquinolin-3-yl) benzenecarbothioate
Property Insights of S-(2-phenylquinolin-3-yl) benzenecarbothioate
The XLogP value of 5.8343 indicates that S-(2-phenylquinolin-3-yl) benzenecarbothioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.96 Ų, S-(2-phenylquinolin-3-yl) benzenecarbothioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, S-(2-phenylquinolin-3-yl) benzenecarbothioate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of S-(2-phenylquinolin-3-yl) benzenecarbothioate?
The CAS number of S-(2-phenylquinolin-3-yl) benzenecarbothioate is 646450-27-3.
What is the molecular formula of S-(2-phenylquinolin-3-yl) benzenecarbothioate?
The molecular formula of S-(2-phenylquinolin-3-yl) benzenecarbothioate is C22H15NOS.
What is the molecular weight of S-(2-phenylquinolin-3-yl) benzenecarbothioate?
The molecular weight of S-(2-phenylquinolin-3-yl) benzenecarbothioate is 341.09 g/mol.
Where can I buy S-(2-phenylquinolin-3-yl) benzenecarbothioate?
You can request a quote for S-(2-phenylquinolin-3-yl) benzenecarbothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-(2-phenylquinolin-3-yl) benzenecarbothioate?
Yes, KEHONG BIO provides custom synthesis services for S-(2-phenylquinolin-3-yl) benzenecarbothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.