![(5-Methyl-[1,3,4]oxadiazol-2-ylsulfanyl)-acetic acid structure](/static/products/842/842965-64-4.png)
(5-Methyl-[1,3,4]oxadiazol-2-ylsulfanyl)-acetic acid
TL;DR: (5-Methyl-[1,3,4]oxadiazol-2-ylsulfanyl)-acetic acid (CAS 842965-64-4) is a chemical compound with molecular formula C5H6N2O3S and molecular weight 174.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetic acid
Also Known As: (5-Methyl-[1,3,4]oxadiazol-2-ylsulfanyl)-acetic acid, [(5-methyl-1,3,4-oxadiazol-2-yl)thio]acetic acid, 2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetic acid, 0403AF, BAS 05494771
| Molecular Formula | C5H6N2O3S |
|---|---|
| Molecular Weight | 174.01 g/mol |
| LogP | 0.55472 |
| Topological Polar Surface Area | 76.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 174.00992 |
| Heavy Atoms | 11 |
| Complexity | 259.98514 |
Chemical Identifiers
| CAS Number | 842965-64-4 |
|---|---|
| SMILES | CC1=NN=C(O1)SCC(=O)O |
Product Overview
(5-Methyl-[1,3,4]oxadiazol-2-ylsulfanyl)-acetic acid (CAS 842965-64-4), with molecular formula C5H6N2O3S and molecular weight 174.01 g/mol. IUPAC: 2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetic acid.
Chemical Property Profile of (5-Methyl-[1,3,4]oxadiazol-2-ylsulfanyl)-acetic acid
Property Insights of (5-Methyl-[1,3,4]oxadiazol-2-ylsulfanyl)-acetic acid
The XLogP value of 0.55472 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5-Methyl-[1,3,4]oxadiazol-2-ylsulfanyl)-acetic acid. The TPSA of 76.22 Ų falls within the moderate polarity range, balancing permeability and solubility for (5-Methyl-[1,3,4]oxadiazol-2-ylsulfanyl)-acetic acid. Following Lipinski's Rule of Five, (5-Methyl-[1,3,4]oxadiazol-2-ylsulfanyl)-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 (5-Methyl-[1,3,4]oxadiazol-2-ylsulfanyl)-acetic acid?
The CAS number of (5-Methyl-[1,3,4]oxadiazol-2-ylsulfanyl)-acetic acid is 842965-64-4.
What is the molecular formula of (5-Methyl-[1,3,4]oxadiazol-2-ylsulfanyl)-acetic acid?
The molecular formula of (5-Methyl-[1,3,4]oxadiazol-2-ylsulfanyl)-acetic acid is C5H6N2O3S.
What is the molecular weight of (5-Methyl-[1,3,4]oxadiazol-2-ylsulfanyl)-acetic acid?
The molecular weight of (5-Methyl-[1,3,4]oxadiazol-2-ylsulfanyl)-acetic acid is 174.01 g/mol.
Where can I buy (5-Methyl-[1,3,4]oxadiazol-2-ylsulfanyl)-acetic acid?
You can request a quote for (5-Methyl-[1,3,4]oxadiazol-2-ylsulfanyl)-acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5-Methyl-[1,3,4]oxadiazol-2-ylsulfanyl)-acetic acid?
Yes, KEHONG BIO provides custom synthesis services for (5-Methyl-[1,3,4]oxadiazol-2-ylsulfanyl)-acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.