![2-[5-(4-Methylsulfonylphenyl)tetrazol-2-yl]acetic acid structure](/static/products/6952/695201-66-2.webp)
2-[5-(4-Methylsulfonylphenyl)tetrazol-2-yl]acetic acid
TL;DR: 2-[5-(4-Methylsulfonylphenyl)tetrazol-2-yl]acetic acid (CAS 695201-66-2) is a chemical compound with molecular formula C10H10N4O4S and molecular weight 282.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[5-(4-methylsulfonylphenyl)tetrazol-2-yl]acetic acid
Also Known As: 8-methylene-tridec-6-yne, 2- -5- -TETRAAZOLE, 2-(CARBOXYMETHYL)-5-(4-METHYLSULFOPHENYL)-TETRAAZOLE, 2-[5-(4-methylsulfonylphenyl)tetrazol-2-yl]acetic acid, A3327/0141279
| Molecular Formula | C10H10N4O4S |
|---|---|
| Molecular Weight | 282.04 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 123.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 282.04227 |
| Heavy Atoms | 19 |
| Complexity | 427.0 |
Chemical Identifiers
| CAS Number | 695201-66-2 |
|---|---|
| SMILES | CS(=O)(=O)C1=CC=C(C=C1)C2=NN(N=N2)CC(=O)O |
| InChIKey | WPMKGMLGEHKJJU-UHFFFAOYSA-N |
Product Overview
2-[5-(4-Methylsulfonylphenyl)tetrazol-2-yl]acetic acid (CAS 695201-66-2), with molecular formula C10H10N4O4S and molecular weight 282.04 g/mol. IUPAC: 2-[5-(4-methylsulfonylphenyl)tetrazol-2-yl]acetic acid.
Chemical Property Profile of 2-[5-(4-Methylsulfonylphenyl)tetrazol-2-yl]acetic acid
Property Insights of 2-[5-(4-Methylsulfonylphenyl)tetrazol-2-yl]acetic acid
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[5-(4-Methylsulfonylphenyl)tetrazol-2-yl]acetic acid. The TPSA of 123.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[5-(4-Methylsulfonylphenyl)tetrazol-2-yl]acetic acid. Following Lipinski's Rule of Five, 2-[5-(4-Methylsulfonylphenyl)tetrazol-2-yl]acetic acid has 1 hydrogen bond donor(s) and 7 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-(4-Methylsulfonylphenyl)tetrazol-2-yl]acetic acid?
The CAS number of 2-[5-(4-Methylsulfonylphenyl)tetrazol-2-yl]acetic acid is 695201-66-2.
What is the molecular formula of 2-[5-(4-Methylsulfonylphenyl)tetrazol-2-yl]acetic acid?
The molecular formula of 2-[5-(4-Methylsulfonylphenyl)tetrazol-2-yl]acetic acid is C10H10N4O4S.
What is the molecular weight of 2-[5-(4-Methylsulfonylphenyl)tetrazol-2-yl]acetic acid?
The molecular weight of 2-[5-(4-Methylsulfonylphenyl)tetrazol-2-yl]acetic acid is 282.04 g/mol.
Where can I buy 2-[5-(4-Methylsulfonylphenyl)tetrazol-2-yl]acetic acid?
You can request a quote for 2-[5-(4-Methylsulfonylphenyl)tetrazol-2-yl]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-[5-(4-Methylsulfonylphenyl)tetrazol-2-yl]acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[5-(4-Methylsulfonylphenyl)tetrazol-2-yl]acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.