3-(Methanesulfinyl)-4-methyl-5-(5-nitrofuran-2-yl)-4H-1,2,4-triazole
TL;DR: 3-(Methanesulfinyl)-4-methyl-5-(5-nitrofuran-2-yl)-4H-1,2,4-triazole (CAS 41834-21-3) is a chemical compound with molecular formula C8H8N4O4S and molecular weight 256.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-3-methylsulfinyl-5-(5-nitrofuran-2-yl)-1,2,4-triazole
Also Known As: 4-Methyl-3-methylsulfinyl-5-(5-nitro-2-furyl)-s-triazole, 4-Methyl-3- -5- -4H-1,2,4-triazole, s-Triazole, 4-methyl-3-methylsulfinyl-5-(5-nitro-2-furyl)-, 4-methyl-3-methylsulfinyl-5-(5-nitrofuran-2-yl)-1,2,4-triazole, 4-Methyl-3-(methylsulfinyl)-5-(5-nitrofuran-2-yl)-4H-1,2,4-triazole
| Molecular Formula | C8H8N4O4S |
|---|---|
| Molecular Weight | 256.03 g/mol |
| LogP | 0.7207 |
| Topological Polar Surface Area | 104.06 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 256.0266 |
| Heavy Atoms | 17 |
| Complexity | 602.4421 |
Chemical Identifiers
| CAS Number | 41834-21-3 |
|---|---|
| SMILES | CN1C(=NN=C1S(=O)C)C2=CC=C(O2)[N+](=O)[O-] |
Product Overview
3-(Methanesulfinyl)-4-methyl-5-(5-nitrofuran-2-yl)-4H-1,2,4-triazole (CAS 41834-21-3), with molecular formula C8H8N4O4S and molecular weight 256.03 g/mol. IUPAC: 4-methyl-3-methylsulfinyl-5-(5-nitrofuran-2-yl)-1,2,4-triazole.
Chemical Property Profile of 3-(Methanesulfinyl)-4-methyl-5-(5-nitrofuran-2-yl)-4H-1,2,4-triazole
Property Insights of 3-(Methanesulfinyl)-4-methyl-5-(5-nitrofuran-2-yl)-4H-1,2,4-triazole
The XLogP value of 0.7207 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Methanesulfinyl)-4-methyl-5-(5-nitrofuran-2-yl)-4H-1,2,4-triazole. The TPSA of 104.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(Methanesulfinyl)-4-methyl-5-(5-nitrofuran-2-yl)-4H-1,2,4-triazole. Following Lipinski's Rule of Five, 3-(Methanesulfinyl)-4-methyl-5-(5-nitrofuran-2-yl)-4H-1,2,4-triazole 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-(Methanesulfinyl)-4-methyl-5-(5-nitrofuran-2-yl)-4H-1,2,4-triazole?
The CAS number of 3-(Methanesulfinyl)-4-methyl-5-(5-nitrofuran-2-yl)-4H-1,2,4-triazole is 41834-21-3.
What is the molecular formula of 3-(Methanesulfinyl)-4-methyl-5-(5-nitrofuran-2-yl)-4H-1,2,4-triazole?
The molecular formula of 3-(Methanesulfinyl)-4-methyl-5-(5-nitrofuran-2-yl)-4H-1,2,4-triazole is C8H8N4O4S.
What is the molecular weight of 3-(Methanesulfinyl)-4-methyl-5-(5-nitrofuran-2-yl)-4H-1,2,4-triazole?
The molecular weight of 3-(Methanesulfinyl)-4-methyl-5-(5-nitrofuran-2-yl)-4H-1,2,4-triazole is 256.03 g/mol.
Where can I buy 3-(Methanesulfinyl)-4-methyl-5-(5-nitrofuran-2-yl)-4H-1,2,4-triazole?
You can request a quote for 3-(Methanesulfinyl)-4-methyl-5-(5-nitrofuran-2-yl)-4H-1,2,4-triazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Methanesulfinyl)-4-methyl-5-(5-nitrofuran-2-yl)-4H-1,2,4-triazole?
Yes, KEHONG BIO provides custom synthesis services for 3-(Methanesulfinyl)-4-methyl-5-(5-nitrofuran-2-yl)-4H-1,2,4-triazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.