Phenyl(quinolin-2-ylsulfanyl)acetic acid
TL;DR: Phenyl(quinolin-2-ylsulfanyl)acetic acid (CAS 66102-80-5) is a chemical compound with molecular formula C17H13NO2S and molecular weight 295.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-phenyl-2-quinolin-2-ylsulfanylacetic acid
Also Known As: phenyl(quinolin-2-ylsulfanyl)acetic acid, 2-phenyl-2-(2-quinolylthio)acetic acid, 2-phenyl-2-quinolin-2-ylsulfanylacetic acid, 2-phenyl-2-(quinolin-2-ylsulfanyl)acetic acid, 2-phenyl-2-quinolin-2-ylsulfanyl-acetic Acid
| Molecular Formula | C17H13NO2S |
|---|---|
| Molecular Weight | 295.07 g/mol |
| LogP | 4.1528 |
| Topological Polar Surface Area | 50.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 295.0667 |
| Heavy Atoms | 21 |
| Complexity | 773.8568 |
Chemical Identifiers
| CAS Number | 66102-80-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(C(=O)O)SC2=NC3=CC=CC=C3C=C2 |
Product Overview
Phenyl(quinolin-2-ylsulfanyl)acetic acid (CAS 66102-80-5), with molecular formula C17H13NO2S and molecular weight 295.07 g/mol. IUPAC: 2-phenyl-2-quinolin-2-ylsulfanylacetic acid.
Chemical Property Profile of Phenyl(quinolin-2-ylsulfanyl)acetic acid
Property Insights of Phenyl(quinolin-2-ylsulfanyl)acetic acid
The XLogP value of 4.1528 indicates that Phenyl(quinolin-2-ylsulfanyl)acetic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.19 Ų, Phenyl(quinolin-2-ylsulfanyl)acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenyl(quinolin-2-ylsulfanyl)acetic acid has 1 hydrogen bond donor(s) and 3 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 Phenyl(quinolin-2-ylsulfanyl)acetic acid?
The CAS number of Phenyl(quinolin-2-ylsulfanyl)acetic acid is 66102-80-5.
What is the molecular formula of Phenyl(quinolin-2-ylsulfanyl)acetic acid?
The molecular formula of Phenyl(quinolin-2-ylsulfanyl)acetic acid is C17H13NO2S.
What is the molecular weight of Phenyl(quinolin-2-ylsulfanyl)acetic acid?
The molecular weight of Phenyl(quinolin-2-ylsulfanyl)acetic acid is 295.07 g/mol.
Where can I buy Phenyl(quinolin-2-ylsulfanyl)acetic acid?
You can request a quote for Phenyl(quinolin-2-ylsulfanyl)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenyl(quinolin-2-ylsulfanyl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for Phenyl(quinolin-2-ylsulfanyl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.