![3-Methyl-6-[5-(4-nitrophenyl)furan-2-yl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole structure](/static/products/7061/7061-82-7.webp)
3-Methyl-6-[5-(4-nitrophenyl)furan-2-yl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
TL;DR: 3-Methyl-6-[5-(4-nitrophenyl)furan-2-yl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole (CAS 7061-82-7) is a chemical compound with molecular formula C14H9N5O3S and molecular weight 327.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-6-[5-(4-nitrophenyl)furan-2-yl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Also Known As: 3-methyl-6-[5-(4-nitrophenyl)furan-2-yl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, 3-Methyl-6-[5-(4-nitrophenyl)furan-2-yl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, 2-methyl-7-[5-(4-nitrophenyl)-2-furyl]-6-thia-1,3,4,8-tetrazabicyclo[3.3.0]octa-2,4,7-triene
| Molecular Formula | C14H9N5O3S |
|---|---|
| Molecular Weight | 327.04 g/mol |
| LogP | 3.32942 |
| Topological Polar Surface Area | 99.36 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 327.0426 |
| Heavy Atoms | 23 |
| Complexity | 1014.83075 |
Chemical Identifiers
| CAS Number | 7061-82-7 |
|---|---|
| SMILES | CC1=NN=C2N1N=C(S2)C3=CC=C(O3)C4=CC=C(C=C4)[N+](=O)[O-] |
Product Overview
3-Methyl-6-[5-(4-nitrophenyl)furan-2-yl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole (CAS 7061-82-7), with molecular formula C14H9N5O3S and molecular weight 327.04 g/mol. IUPAC: 3-methyl-6-[5-(4-nitrophenyl)furan-2-yl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole.
Chemical Property Profile of 3-Methyl-6-[5-(4-nitrophenyl)furan-2-yl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Property Insights of 3-Methyl-6-[5-(4-nitrophenyl)furan-2-yl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
The XLogP value of 3.32942 indicates that 3-Methyl-6-[5-(4-nitrophenyl)furan-2-yl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.36 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Methyl-6-[5-(4-nitrophenyl)furan-2-yl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole. Following Lipinski's Rule of Five, 3-Methyl-6-[5-(4-nitrophenyl)furan-2-yl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole has 0 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 3-Methyl-6-[5-(4-nitrophenyl)furan-2-yl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole?
The CAS number of 3-Methyl-6-[5-(4-nitrophenyl)furan-2-yl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole is 7061-82-7.
What is the molecular formula of 3-Methyl-6-[5-(4-nitrophenyl)furan-2-yl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole?
The molecular formula of 3-Methyl-6-[5-(4-nitrophenyl)furan-2-yl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole is C14H9N5O3S.
What is the molecular weight of 3-Methyl-6-[5-(4-nitrophenyl)furan-2-yl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole?
The molecular weight of 3-Methyl-6-[5-(4-nitrophenyl)furan-2-yl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole is 327.04 g/mol.
Where can I buy 3-Methyl-6-[5-(4-nitrophenyl)furan-2-yl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole?
You can request a quote for 3-Methyl-6-[5-(4-nitrophenyl)furan-2-yl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methyl-6-[5-(4-nitrophenyl)furan-2-yl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyl-6-[5-(4-nitrophenyl)furan-2-yl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.