![2-{[(4-Fluorophenyl)methyl]sulfanyl}-3-methylquinoxaline structure](/static/products/7122/712295-59-5.webp)
2-{[(4-Fluorophenyl)methyl]sulfanyl}-3-methylquinoxaline
TL;DR: 2-{[(4-Fluorophenyl)methyl]sulfanyl}-3-methylquinoxaline (CAS 712295-59-5) is a chemical compound with molecular formula C16H13FN2S and molecular weight 284.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-fluorophenyl)methylsulfanyl]-3-methylquinoxaline
Also Known As: 2-[(4-fluorophenyl)methylthio]-3-methylquinoxaline, 2-{[(4-FLUOROPHENYL)METHYL]SULFANYL}-3-METHYLQUINOXALINE, 2-[(4-fluorophenyl)methylsulfanyl]-3-methylquinoxaline
| Molecular Formula | C16H13FN2S |
|---|---|
| Molecular Weight | 284.08 g/mol |
| LogP | 4.36962 |
| Topological Polar Surface Area | 25.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 284.07834 |
| Heavy Atoms | 20 |
| Complexity | 741.053 |
Chemical Identifiers
| CAS Number | 712295-59-5 |
|---|---|
| SMILES | CC1=NC2=CC=CC=C2N=C1SCC3=CC=C(C=C3)F |
Product Overview
2-{[(4-Fluorophenyl)methyl]sulfanyl}-3-methylquinoxaline (CAS 712295-59-5), with molecular formula C16H13FN2S and molecular weight 284.08 g/mol. IUPAC: 2-[(4-fluorophenyl)methylsulfanyl]-3-methylquinoxaline.
Chemical Property Profile of 2-{[(4-Fluorophenyl)methyl]sulfanyl}-3-methylquinoxaline
Property Insights of 2-{[(4-Fluorophenyl)methyl]sulfanyl}-3-methylquinoxaline
The XLogP value of 4.36962 indicates that 2-{[(4-Fluorophenyl)methyl]sulfanyl}-3-methylquinoxaline 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-{[(4-Fluorophenyl)methyl]sulfanyl}-3-methylquinoxaline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-{[(4-Fluorophenyl)methyl]sulfanyl}-3-methylquinoxaline has 0 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-{[(4-Fluorophenyl)methyl]sulfanyl}-3-methylquinoxaline?
The CAS number of 2-{[(4-Fluorophenyl)methyl]sulfanyl}-3-methylquinoxaline is 712295-59-5.
What is the molecular formula of 2-{[(4-Fluorophenyl)methyl]sulfanyl}-3-methylquinoxaline?
The molecular formula of 2-{[(4-Fluorophenyl)methyl]sulfanyl}-3-methylquinoxaline is C16H13FN2S.
What is the molecular weight of 2-{[(4-Fluorophenyl)methyl]sulfanyl}-3-methylquinoxaline?
The molecular weight of 2-{[(4-Fluorophenyl)methyl]sulfanyl}-3-methylquinoxaline is 284.08 g/mol.
Where can I buy 2-{[(4-Fluorophenyl)methyl]sulfanyl}-3-methylquinoxaline?
You can request a quote for 2-{[(4-Fluorophenyl)methyl]sulfanyl}-3-methylquinoxaline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{[(4-Fluorophenyl)methyl]sulfanyl}-3-methylquinoxaline?
Yes, KEHONG BIO provides custom synthesis services for 2-{[(4-Fluorophenyl)methyl]sulfanyl}-3-methylquinoxaline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.