![2-(4-Fluoro-2-{[4-(propan-2-yl)phenyl]sulfanyl}phenyl)acetic acid structure](/static/products/6860/68600-06-6.webp)
2-(4-Fluoro-2-{[4-(propan-2-yl)phenyl]sulfanyl}phenyl)acetic acid
TL;DR: 2-(4-Fluoro-2-{[4-(propan-2-yl)phenyl]sulfanyl}phenyl)acetic acid (CAS 68600-06-6) is a chemical compound with molecular formula C17H17FO2S and molecular weight 304.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-fluoro-2-(4-propan-2-ylphenyl)sulfanylphenyl]acetic acid
Also Known As: AE-641/06283002, 2-(4-fluoro-2-{[4-(propan-2-yl)phenyl]sulfanyl}phenyl)aceticacid, 2-(4-fluoro-2-{[4-(propan-2-yl)phenyl]sulfanyl}phenyl)acetic acid, {4-fluoro-2-[(4-isopropylphenyl)sulfanyl]phenyl}acetic acid, 2-[4-fluoro-2-(4-propan-2-ylphenyl)sulfanylphenyl]acetic acid
| Molecular Formula | C17H17FO2S |
|---|---|
| Molecular Weight | 304.09 g/mol |
| LogP | 4.7274 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 304.09332 |
| Heavy Atoms | 21 |
| Complexity | 635.7384 |
Chemical Identifiers
| CAS Number | 68600-06-6 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)SC2=C(C=CC(=C2)F)CC(=O)O |
Product Overview
2-(4-Fluoro-2-{[4-(propan-2-yl)phenyl]sulfanyl}phenyl)acetic acid (CAS 68600-06-6), with molecular formula C17H17FO2S and molecular weight 304.09 g/mol. IUPAC: 2-[4-fluoro-2-(4-propan-2-ylphenyl)sulfanylphenyl]acetic acid.
Chemical Property Profile of 2-(4-Fluoro-2-{[4-(propan-2-yl)phenyl]sulfanyl}phenyl)acetic acid
Property Insights of 2-(4-Fluoro-2-{[4-(propan-2-yl)phenyl]sulfanyl}phenyl)acetic acid
The XLogP value of 4.7274 indicates that 2-(4-Fluoro-2-{[4-(propan-2-yl)phenyl]sulfanyl}phenyl)acetic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 2-(4-Fluoro-2-{[4-(propan-2-yl)phenyl]sulfanyl}phenyl)acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Fluoro-2-{[4-(propan-2-yl)phenyl]sulfanyl}phenyl)acetic acid 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 2-(4-Fluoro-2-{[4-(propan-2-yl)phenyl]sulfanyl}phenyl)acetic acid?
The CAS number of 2-(4-Fluoro-2-{[4-(propan-2-yl)phenyl]sulfanyl}phenyl)acetic acid is 68600-06-6.
What is the molecular formula of 2-(4-Fluoro-2-{[4-(propan-2-yl)phenyl]sulfanyl}phenyl)acetic acid?
The molecular formula of 2-(4-Fluoro-2-{[4-(propan-2-yl)phenyl]sulfanyl}phenyl)acetic acid is C17H17FO2S.
What is the molecular weight of 2-(4-Fluoro-2-{[4-(propan-2-yl)phenyl]sulfanyl}phenyl)acetic acid?
The molecular weight of 2-(4-Fluoro-2-{[4-(propan-2-yl)phenyl]sulfanyl}phenyl)acetic acid is 304.09 g/mol.
Where can I buy 2-(4-Fluoro-2-{[4-(propan-2-yl)phenyl]sulfanyl}phenyl)acetic acid?
You can request a quote for 2-(4-Fluoro-2-{[4-(propan-2-yl)phenyl]sulfanyl}phenyl)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Fluoro-2-{[4-(propan-2-yl)phenyl]sulfanyl}phenyl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Fluoro-2-{[4-(propan-2-yl)phenyl]sulfanyl}phenyl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.