2-(5-Chloro-1-benzothiophen-3-yl)acetic acid
TL;DR: 2-(5-Chloro-1-benzothiophen-3-yl)acetic acid (CAS 17266-30-7) is a chemical compound with molecular formula C10H7ClO2S and molecular weight 225.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(5-Chloro-1-benzothiophen-3-yl)acetic acid
2-(5-chloro-1-benzothiophen-3-yl)acetic acid
Also Known As: 2-(5-Chlorobenzo[b]thiophen-3-yl)acetic acid, 5-Chlorobenzo[b]thiophene-3-acetic acid, 2-(5-chloro-1-benzothiophen-3-yl)acetic acid, Maybridge4_002620, (5-chloro-1-benzothiophen-3-yl)acetic acid
| Molecular Formula | C10H7ClO2S |
|---|---|
| Molecular Weight | 225.99 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 65.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 225.98553 |
| Heavy Atoms | 14 |
| Complexity | 234.0 |
Chemical Identifiers
| CAS Number | 17266-30-7 |
|---|---|
| SMILES | C1=CC2=C(C=C1Cl)C(=CS2)CC(=O)O |
| InChIKey | QQKKTOPRRGBBCT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(5-Chloro-1-benzothiophen-3-yl)acetic acid (CAS 17266-30-7), with molecular formula C10H7ClO2S and molecular weight 225.99 g/mol. IUPAC: 2-(5-chloro-1-benzothiophen-3-yl)acetic acid.
Chemical Property Profile of 2-(5-Chloro-1-benzothiophen-3-yl)acetic acid
Property Insights of 2-(5-Chloro-1-benzothiophen-3-yl)acetic acid
The XLogP value of 3.0 indicates that 2-(5-氯-1-苯并噻吩-3-基)乙酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(5-Chloro-1-benzothiophen-3-yl)acetic acid. Following Lipinski's Rule of Five, 2-(5-氯-1-苯并噻吩-3-基)乙酸 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-(5-氯-1-苯并噻吩-3-基)乙酸?
The CAS number of 2-(5-氯-1-苯并噻吩-3-基)乙酸 is 17266-30-7.
What is the molecular formula of 2-(5-氯-1-苯并噻吩-3-基)乙酸?
The molecular formula of 2-(5-氯-1-苯并噻吩-3-基)乙酸 is C10H7ClO2S.
What is the molecular weight of 2-(5-氯-1-苯并噻吩-3-基)乙酸?
The molecular weight of 2-(5-氯-1-苯并噻吩-3-基)乙酸 is 225.99 g/mol.
Where can I buy 2-(5-氯-1-苯并噻吩-3-基)乙酸?
You can request a quote for 2-(5-氯-1-苯并噻吩-3-基)乙酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(5-氯-1-苯并噻吩-3-基)乙酸?
Yes, KEHONG BIO provides custom synthesis services for 2-(5-氯-1-苯并噻吩-3-基)乙酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.