![3-[(5-Benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]propanoic acid structure](/static/products/889/889946-29-6.png)
3-[(5-Benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]propanoic acid
TL;DR: 3-[(5-Benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]propanoic acid (CAS 889946-29-6) is a chemical compound with molecular formula C12H12N2O3S and molecular weight 264.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(5-benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]propanoic acid
Also Known As: 3-[(5-benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]propanoic acid, 3-((5-benzyl-1,3,4-oxadiazol-2-yl)thio)propanoic acid
| Molecular Formula | C12H12N2O3S |
|---|---|
| Molecular Weight | 264.06 g/mol |
| LogP | 2.2272 |
| Topological Polar Surface Area | 76.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 264.05685 |
| Heavy Atoms | 18 |
| Complexity | 513.0509 |
Chemical Identifiers
| CAS Number | 889946-29-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC2=NN=C(O2)SCCC(=O)O |
Product Overview
3-[(5-Benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]propanoic acid (CAS 889946-29-6), with molecular formula C12H12N2O3S and molecular weight 264.06 g/mol. IUPAC: 3-[(5-benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]propanoic acid.
Chemical Property Profile of 3-[(5-Benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]propanoic acid
Property Insights of 3-[(5-Benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]propanoic acid
The XLogP value of 2.2272 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(5-Benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]propanoic acid. The TPSA of 76.22 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(5-Benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]propanoic acid. Following Lipinski's Rule of Five, 3-[(5-Benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]propanoic 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 3-[(5-Benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]propanoic acid?
The CAS number of 3-[(5-Benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]propanoic acid is 889946-29-6.
What is the molecular formula of 3-[(5-Benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]propanoic acid?
The molecular formula of 3-[(5-Benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]propanoic acid is C12H12N2O3S.
What is the molecular weight of 3-[(5-Benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]propanoic acid?
The molecular weight of 3-[(5-Benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]propanoic acid is 264.06 g/mol.
Where can I buy 3-[(5-Benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]propanoic acid?
You can request a quote for 3-[(5-Benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(5-Benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[(5-Benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.