3-Methyl-5-(5-nitrofuran-2-yl)-1,2,4-oxadiazole
TL;DR: 3-Methyl-5-(5-nitrofuran-2-yl)-1,2,4-oxadiazole (CAS 1455-83-0) is a chemical compound with molecular formula C7H5N3O4 and molecular weight 195.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-5-(5-nitrofuran-2-yl)-1,2,4-oxadiazole
Also Known As: 1,2,4-Oxadiazole der., 3-methyl-5-(5-nitrofuran-2-yl)-1,2,4-oxadiazole, 1,4-Oxadiazole, 3-methyl-5-(5-nitro-2-furanyl)-, 3-Methyl-5-(5-nitro-2-furyl)-1,2,4-oxadiazole
| Molecular Formula | C7H5N3O4 |
|---|---|
| Molecular Weight | 195.03 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 97.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 195.028 |
| Heavy Atoms | 14 |
| Complexity | 231.0 |
Chemical Identifiers
| CAS Number | 1455-83-0 |
|---|---|
| SMILES | CC1=NOC(=N1)C2=CC=C(O2)[N+](=O)[O-] |
| InChIKey | WEHPEFNACJTHBC-UHFFFAOYSA-N |
Product Overview
3-Methyl-5-(5-nitrofuran-2-yl)-1,2,4-oxadiazole (CAS 1455-83-0), with molecular formula C7H5N3O4 and molecular weight 195.03 g/mol. IUPAC: 3-methyl-5-(5-nitrofuran-2-yl)-1,2,4-oxadiazole.
Chemical Property Profile of 3-Methyl-5-(5-nitrofuran-2-yl)-1,2,4-oxadiazole
Property Insights of 3-Methyl-5-(5-nitrofuran-2-yl)-1,2,4-oxadiazole
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methyl-5-(5-nitrofuran-2-yl)-1,2,4-oxadiazole. The TPSA of 97.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Methyl-5-(5-nitrofuran-2-yl)-1,2,4-oxadiazole. Following Lipinski's Rule of Five, 3-Methyl-5-(5-nitrofuran-2-yl)-1,2,4-oxadiazole has 0 hydrogen bond donor(s) and 6 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-Methyl-5-(5-nitrofuran-2-yl)-1,2,4-oxadiazole?
The CAS number of 3-Methyl-5-(5-nitrofuran-2-yl)-1,2,4-oxadiazole is 1455-83-0.
What is the molecular formula of 3-Methyl-5-(5-nitrofuran-2-yl)-1,2,4-oxadiazole?
The molecular formula of 3-Methyl-5-(5-nitrofuran-2-yl)-1,2,4-oxadiazole is C7H5N3O4.
What is the molecular weight of 3-Methyl-5-(5-nitrofuran-2-yl)-1,2,4-oxadiazole?
The molecular weight of 3-Methyl-5-(5-nitrofuran-2-yl)-1,2,4-oxadiazole is 195.03 g/mol.
Where can I buy 3-Methyl-5-(5-nitrofuran-2-yl)-1,2,4-oxadiazole?
You can request a quote for 3-Methyl-5-(5-nitrofuran-2-yl)-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 3-Methyl-5-(5-nitrofuran-2-yl)-1,2,4-oxadiazole?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyl-5-(5-nitrofuran-2-yl)-1,2,4-oxadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.