![2-[1-(1,3-Benzothiazol-2-yl)-2-(furan-2-yl)ethenyl]sulfanylacetic acid structure](/static/products/852/852706-24-2.png)
2-[1-(1,3-Benzothiazol-2-yl)-2-(furan-2-yl)ethenyl]sulfanylacetic acid
TL;DR: 2-[1-(1,3-Benzothiazol-2-yl)-2-(furan-2-yl)ethenyl]sulfanylacetic acid (CAS 852706-24-2) is a chemical compound with molecular formula C15H11NO3S2 and molecular weight 317.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-(1,3-benzothiazol-2-yl)-2-(furan-2-yl)ethenyl]sulfanylacetic acid
Also Known As: 2-{[1-(1,3-benzothiazol-2-yl)-2-(furan-2-yl)ethenyl]sulfanyl}acetic acid, {[1-(1,3-benzothiazol-2-yl)-2-(furan-2-yl)ethenyl]sulfanyl}acetic acid, 2-[1-benzothiazol-2-yl-2-(2-furyl)ethenyl]sulfanylacetic Acid, ([1-(1,3-benzothiazol-2-yl)-2-(2-furyl)vinyl]thio)acetic acid, {[1-(1,3-benzothiazol-2-yl)-2-(2-furyl)vinyl]thio}acetic acid
| Molecular Formula | C15H11NO3S2 |
|---|---|
| Molecular Weight | 317.02 g/mol |
| LogP | 4.2052 |
| Topological Polar Surface Area | 63.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 317.01804 |
| Heavy Atoms | 21 |
| Complexity | 757.2261 |
Chemical Identifiers
| CAS Number | 852706-24-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(S2)C(=CC3=CC=CO3)SCC(=O)O |
Product Overview
2-[1-(1,3-Benzothiazol-2-yl)-2-(furan-2-yl)ethenyl]sulfanylacetic acid (CAS 852706-24-2), with molecular formula C15H11NO3S2 and molecular weight 317.02 g/mol. IUPAC: 2-[1-(1,3-benzothiazol-2-yl)-2-(furan-2-yl)ethenyl]sulfanylacetic acid.
Chemical Property Profile of 2-[1-(1,3-Benzothiazol-2-yl)-2-(furan-2-yl)ethenyl]sulfanylacetic acid
Property Insights of 2-[1-(1,3-Benzothiazol-2-yl)-2-(furan-2-yl)ethenyl]sulfanylacetic acid
The XLogP value of 4.2052 indicates that 2-[1-(1,3-Benzothiazol-2-yl)-2-(furan-2-yl)ethenyl]sulfanylacetic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.33 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[1-(1,3-Benzothiazol-2-yl)-2-(furan-2-yl)ethenyl]sulfanylacetic acid. Following Lipinski's Rule of Five, 2-[1-(1,3-Benzothiazol-2-yl)-2-(furan-2-yl)ethenyl]sulfanylacetic acid has 1 hydrogen bond donor(s) and 5 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-[1-(1,3-Benzothiazol-2-yl)-2-(furan-2-yl)ethenyl]sulfanylacetic acid?
The CAS number of 2-[1-(1,3-Benzothiazol-2-yl)-2-(furan-2-yl)ethenyl]sulfanylacetic acid is 852706-24-2.
What is the molecular formula of 2-[1-(1,3-Benzothiazol-2-yl)-2-(furan-2-yl)ethenyl]sulfanylacetic acid?
The molecular formula of 2-[1-(1,3-Benzothiazol-2-yl)-2-(furan-2-yl)ethenyl]sulfanylacetic acid is C15H11NO3S2.
What is the molecular weight of 2-[1-(1,3-Benzothiazol-2-yl)-2-(furan-2-yl)ethenyl]sulfanylacetic acid?
The molecular weight of 2-[1-(1,3-Benzothiazol-2-yl)-2-(furan-2-yl)ethenyl]sulfanylacetic acid is 317.02 g/mol.
Where can I buy 2-[1-(1,3-Benzothiazol-2-yl)-2-(furan-2-yl)ethenyl]sulfanylacetic acid?
You can request a quote for 2-[1-(1,3-Benzothiazol-2-yl)-2-(furan-2-yl)ethenyl]sulfanylacetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[1-(1,3-Benzothiazol-2-yl)-2-(furan-2-yl)ethenyl]sulfanylacetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[1-(1,3-Benzothiazol-2-yl)-2-(furan-2-yl)ethenyl]sulfanylacetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.