2-(Phenylsulfanyl)quinoline-4-carboxamide
TL;DR: 2-(Phenylsulfanyl)quinoline-4-carboxamide (CAS 91972-60-0) is a chemical compound with molecular formula C16H12N2OS and molecular weight 280.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-phenylsulfanylquinoline-4-carboxamide
Also Known As: 2-(phenylsulfanyl)quinoline-4-carboxamide, 2-phenylsulfanylquinoline-4-carboxamide, 2-Phenylmercapto-chinolin-4-carbonsaeure-amid, 2-(phenylthio)cinchoninamide, 2-(phenylthio)-4-quinolinecarboxamide
| Molecular Formula | C16H12N2OS |
|---|---|
| Molecular Weight | 280.07 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 81.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 280.06705 |
| Heavy Atoms | 20 |
| Complexity | 343.0 |
Chemical Identifiers
| CAS Number | 91972-60-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)SC2=NC3=CC=CC=C3C(=C2)C(=O)N |
| InChIKey | VUJPGFYDLGOFGY-UHFFFAOYSA-N |
Product Overview
2-(Phenylsulfanyl)quinoline-4-carboxamide (CAS 91972-60-0), with molecular formula C16H12N2OS and molecular weight 280.07 g/mol. IUPAC: 2-phenylsulfanylquinoline-4-carboxamide.
Chemical Property Profile of 2-(Phenylsulfanyl)quinoline-4-carboxamide
Property Insights of 2-(Phenylsulfanyl)quinoline-4-carboxamide
The XLogP value of 3.5 indicates that 2-(Phenylsulfanyl)quinoline-4-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Phenylsulfanyl)quinoline-4-carboxamide. Following Lipinski's Rule of Five, 2-(Phenylsulfanyl)quinoline-4-carboxamide 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 2-(Phenylsulfanyl)quinoline-4-carboxamide?
The CAS number of 2-(Phenylsulfanyl)quinoline-4-carboxamide is 91972-60-0.
What is the molecular formula of 2-(Phenylsulfanyl)quinoline-4-carboxamide?
The molecular formula of 2-(Phenylsulfanyl)quinoline-4-carboxamide is C16H12N2OS.
What is the molecular weight of 2-(Phenylsulfanyl)quinoline-4-carboxamide?
The molecular weight of 2-(Phenylsulfanyl)quinoline-4-carboxamide is 280.07 g/mol.
Where can I buy 2-(Phenylsulfanyl)quinoline-4-carboxamide?
You can request a quote for 2-(Phenylsulfanyl)quinoline-4-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Phenylsulfanyl)quinoline-4-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(Phenylsulfanyl)quinoline-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.