3-phenylquinoxaline-2(1H)-thione
TL;DR: 3-phenylquinoxaline-2(1H)-thione (CAS 58861-61-3) is a chemical compound with molecular formula C14H10N2S and molecular weight 238.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-phenyl-1H-quinoxaline-2-thione
Also Known As: 3-phenylquinoxaline-2-thiol, 3-phenyl-1H-quinoxaline-2-thione, 3-phenylquinoxaline-2(1h)-thione, 3-PHENYL-QUINOXALINE-2-THIOL, 2-Thio-3-phenylchinoxalin
| Molecular Formula | C14H10N2S |
|---|---|
| Molecular Weight | 238.06 g/mol |
| LogP | 3.95939 |
| Topological Polar Surface Area | 28.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 238.05647 |
| Heavy Atoms | 17 |
| Complexity | 716.8738 |
Chemical Identifiers
| CAS Number | 58861-61-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NC3=CC=CC=C3NC2=S |
Product Overview
3-phenylquinoxaline-2(1H)-thione (CAS 58861-61-3), with molecular formula C14H10N2S and molecular weight 238.06 g/mol. IUPAC: 3-phenyl-1H-quinoxaline-2-thione.
Chemical Property Profile of 3-phenylquinoxaline-2(1H)-thione
Property Insights of 3-phenylquinoxaline-2(1H)-thione
The XLogP value of 3.95939 indicates that 3-phenylquinoxaline-2(1H)-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.68 Ų, 3-phenylquinoxaline-2(1H)-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-phenylquinoxaline-2(1H)-thione has 1 hydrogen bond donor(s) and 2 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 3-phenylquinoxaline-2(1H)-thione?
The CAS number of 3-phenylquinoxaline-2(1H)-thione is 58861-61-3.
What is the molecular formula of 3-phenylquinoxaline-2(1H)-thione?
The molecular formula of 3-phenylquinoxaline-2(1H)-thione is C14H10N2S.
What is the molecular weight of 3-phenylquinoxaline-2(1H)-thione?
The molecular weight of 3-phenylquinoxaline-2(1H)-thione is 238.06 g/mol.
Where can I buy 3-phenylquinoxaline-2(1H)-thione?
You can request a quote for 3-phenylquinoxaline-2(1H)-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-phenylquinoxaline-2(1H)-thione?
Yes, KEHONG BIO provides custom synthesis services for 3-phenylquinoxaline-2(1H)-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.