![{[1-(3-chloro-4-fluorophenyl)-1H-tetrazol-5-yl]sulfanyl}acetic acid structure](/static/products/4037/403735-60-4.webp)
{[1-(3-chloro-4-fluorophenyl)-1H-tetrazol-5-yl]sulfanyl}acetic acid
TL;DR: {[1-(3-chloro-4-fluorophenyl)-1H-tetrazol-5-yl]sulfanyl}acetic acid (CAS 403735-60-4) is a chemical compound with molecular formula C9H6ClFN4O2S and molecular weight 287.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-(3-chloro-4-fluorophenyl)tetrazol-5-yl]sulfanylacetic acid
Also Known As: AN-989/14834065, 2-((1-(3-chloro-4-fluorophenyl)-1H-tetrazol-5-yl)thio)acetic acid, 2-[1-(3-chloro-4-fluoro-phenyl)tetrazol-5-yl]sulfanylacetic Acid, 2-[1-(3-chloro-4-fluorophenyl)tetrazol-5-yl]sulfanylacetic acid, {[1-(3-chloro-4-fluorophenyl)-1H-tetraazol-5-yl]sulfanyl}acetic acid
| Molecular Formula | C9H6ClFN4O2S |
|---|---|
| Molecular Weight | 287.99 g/mol |
| LogP | 1.6315 |
| Topological Polar Surface Area | 80.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 287.9884 |
| Heavy Atoms | 18 |
| Complexity | 591.69666 |
Chemical Identifiers
| CAS Number | 403735-60-4 |
|---|---|
| SMILES | C1=CC(=C(C=C1N2C(=NN=N2)SCC(=O)O)Cl)F |
Product Overview
{[1-(3-chloro-4-fluorophenyl)-1H-tetrazol-5-yl]sulfanyl}acetic acid (CAS 403735-60-4), with molecular formula C9H6ClFN4O2S and molecular weight 287.99 g/mol. IUPAC: 2-[1-(3-chloro-4-fluorophenyl)tetrazol-5-yl]sulfanylacetic acid.
Chemical Property Profile of {[1-(3-chloro-4-fluorophenyl)-1H-tetrazol-5-yl]sulfanyl}acetic acid
Property Insights of {[1-(3-chloro-4-fluorophenyl)-1H-tetrazol-5-yl]sulfanyl}acetic acid
The XLogP value of 1.6315 suggests moderate lipophilicity, balancing water solubility and membrane permeability for {[1-(3-chloro-4-fluorophenyl)-1H-tetrazol-5-yl]sulfanyl}acetic acid. The TPSA of 80.9 Ų falls within the moderate polarity range, balancing permeability and solubility for {[1-(3-chloro-4-fluorophenyl)-1H-tetrazol-5-yl]sulfanyl}acetic acid. Following Lipinski's Rule of Five, {[1-(3-chloro-4-fluorophenyl)-1H-tetrazol-5-yl]sulfanyl}acetic 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 {[1-(3-chloro-4-fluorophenyl)-1H-tetrazol-5-yl]sulfanyl}acetic acid?
The CAS number of {[1-(3-chloro-4-fluorophenyl)-1H-tetrazol-5-yl]sulfanyl}acetic acid is 403735-60-4.
What is the molecular formula of {[1-(3-chloro-4-fluorophenyl)-1H-tetrazol-5-yl]sulfanyl}acetic acid?
The molecular formula of {[1-(3-chloro-4-fluorophenyl)-1H-tetrazol-5-yl]sulfanyl}acetic acid is C9H6ClFN4O2S.
What is the molecular weight of {[1-(3-chloro-4-fluorophenyl)-1H-tetrazol-5-yl]sulfanyl}acetic acid?
The molecular weight of {[1-(3-chloro-4-fluorophenyl)-1H-tetrazol-5-yl]sulfanyl}acetic acid is 287.99 g/mol.
Where can I buy {[1-(3-chloro-4-fluorophenyl)-1H-tetrazol-5-yl]sulfanyl}acetic acid?
You can request a quote for {[1-(3-chloro-4-fluorophenyl)-1H-tetrazol-5-yl]sulfanyl}acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for {[1-(3-chloro-4-fluorophenyl)-1H-tetrazol-5-yl]sulfanyl}acetic acid?
Yes, KEHONG BIO provides custom synthesis services for {[1-(3-chloro-4-fluorophenyl)-1H-tetrazol-5-yl]sulfanyl}acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.