4-(3-Thien-2-yl-1,2,4-oxadiazol-5-yl)butanoic acid
TL;DR: 4-(3-Thien-2-yl-1,2,4-oxadiazol-5-yl)butanoic acid (CAS 700-96-9) is a chemical compound with molecular formula C10H10N2O3S and molecular weight 238.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)butanoic acid
Also Known As: Nafetolol, 4-(3-thien-2-yl-1,2,4-oxadiazol-5-yl)butanoic acid, 3,4-Dimethoxythiophenol, MixCom1_000127, Peakdale1_002877
| Molecular Formula | C10H10N2O3S |
|---|---|
| Molecular Weight | 238.04 g/mol |
| LogP | 2.2054 |
| Topological Polar Surface Area | 76.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 238.04121 |
| Heavy Atoms | 16 |
| Complexity | 464.12735 |
Chemical Identifiers
| CAS Number | 700-96-9 |
|---|---|
| SMILES | C1=CSC(=C1)C2=NOC(=N2)CCCC(=O)O |
Product Overview
4-(3-Thien-2-yl-1,2,4-oxadiazol-5-yl)butanoic acid (CAS 700-96-9), with molecular formula C10H10N2O3S and molecular weight 238.04 g/mol. IUPAC: 4-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)butanoic acid.
Chemical Property Profile of 4-(3-Thien-2-yl-1,2,4-oxadiazol-5-yl)butanoic acid
Property Insights of 4-(3-Thien-2-yl-1,2,4-oxadiazol-5-yl)butanoic acid
The XLogP value of 2.2054 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(3-Thien-2-yl-1,2,4-oxadiazol-5-yl)butanoic acid. The TPSA of 76.22 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(3-Thien-2-yl-1,2,4-oxadiazol-5-yl)butanoic acid. Following Lipinski's Rule of Five, 4-(3-Thien-2-yl-1,2,4-oxadiazol-5-yl)butanoic 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 4-(3-Thien-2-yl-1,2,4-oxadiazol-5-yl)butanoic acid?
The CAS number of 4-(3-Thien-2-yl-1,2,4-oxadiazol-5-yl)butanoic acid is 700-96-9.
What is the molecular formula of 4-(3-Thien-2-yl-1,2,4-oxadiazol-5-yl)butanoic acid?
The molecular formula of 4-(3-Thien-2-yl-1,2,4-oxadiazol-5-yl)butanoic acid is C10H10N2O3S.
What is the molecular weight of 4-(3-Thien-2-yl-1,2,4-oxadiazol-5-yl)butanoic acid?
The molecular weight of 4-(3-Thien-2-yl-1,2,4-oxadiazol-5-yl)butanoic acid is 238.04 g/mol.
Where can I buy 4-(3-Thien-2-yl-1,2,4-oxadiazol-5-yl)butanoic acid?
You can request a quote for 4-(3-Thien-2-yl-1,2,4-oxadiazol-5-yl)butanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(3-Thien-2-yl-1,2,4-oxadiazol-5-yl)butanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(3-Thien-2-yl-1,2,4-oxadiazol-5-yl)butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.