5-Amino-3-(2-(5-nitro-2-furyl)vinyl)-1,2,4-oxadiazole
TL;DR: 5-Amino-3-(2-(5-nitro-2-furyl)vinyl)-1,2,4-oxadiazole (CAS 21959-57-9) is a chemical compound with molecular formula C8H6N4O4 and molecular weight 222.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-(5-nitrofuran-2-yl)ethenyl]-1,2,4-oxadiazol-5-amine
Also Known As: 3-[2-(5-nitrofuran-2-yl)ethenyl]-1,2,4-oxadiazol-5-amine, 5-Amino-3-(2-(5-nitro-2-furyl)vinyl)-1,2,4-oxadiazole, S 18506, 1,2,4-Oxadiazole, 5-amino-3-(2-(5-nitro-2-furyl)vinyl)-, 1,2,4-Oxadiazol-5-amine, 3-(2-(5-nitro-2-furanyl)ethenyl)-
| Molecular Formula | C8H6N4O4 |
|---|---|
| Molecular Weight | 222.04 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 124.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 222.03891 |
| Heavy Atoms | 16 |
| Complexity | 292.0 |
Chemical Identifiers
| CAS Number | 21959-57-9 |
|---|---|
| SMILES | C1=C(OC(=C1)[N+](=O)[O-])C=CC2=NOC(=N2)N |
| InChIKey | RMZNNIOKNRDECR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Amino-3-(2-(5-nitro-2-furyl)vinyl)-1,2,4-oxadiazole (CAS 21959-57-9), with molecular formula C8H6N4O4 and molecular weight 222.04 g/mol. IUPAC: 3-[2-(5-nitrofuran-2-yl)ethenyl]-1,2,4-oxadiazol-5-amine.
Chemical Property Profile of 5-Amino-3-(2-(5-nitro-2-furyl)vinyl)-1,2,4-oxadiazole
Property Insights of 5-Amino-3-(2-(5-nitro-2-furyl)vinyl)-1,2,4-oxadiazole
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Amino-3-(2-(5-nitro-2-furyl)vinyl)-1,2,4-oxadiazole. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Amino-3-(2-(5-nitro-2-furyl)vinyl)-1,2,4-oxadiazole. Following Lipinski's Rule of Five, 5-Amino-3-(2-(5-nitro-2-furyl)vinyl)-1,2,4-oxadiazole 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 5-Amino-3-(2-(5-nitro-2-furyl)vinyl)-1,2,4-oxadiazole?
The CAS number of 5-Amino-3-(2-(5-nitro-2-furyl)vinyl)-1,2,4-oxadiazole is 21959-57-9.
What is the molecular formula of 5-Amino-3-(2-(5-nitro-2-furyl)vinyl)-1,2,4-oxadiazole?
The molecular formula of 5-Amino-3-(2-(5-nitro-2-furyl)vinyl)-1,2,4-oxadiazole is C8H6N4O4.
What is the molecular weight of 5-Amino-3-(2-(5-nitro-2-furyl)vinyl)-1,2,4-oxadiazole?
The molecular weight of 5-Amino-3-(2-(5-nitro-2-furyl)vinyl)-1,2,4-oxadiazole is 222.04 g/mol.
Where can I buy 5-Amino-3-(2-(5-nitro-2-furyl)vinyl)-1,2,4-oxadiazole?
You can request a quote for 5-Amino-3-(2-(5-nitro-2-furyl)vinyl)-1,2,4-oxadiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Amino-3-(2-(5-nitro-2-furyl)vinyl)-1,2,4-oxadiazole?
Yes, KEHONG BIO provides custom synthesis services for 5-Amino-3-(2-(5-nitro-2-furyl)vinyl)-1,2,4-oxadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.