1-(2-Methyl-5-nitro-1,2,4-triazol-3-yl)benzimidazole
TL;DR: 1-(2-Methyl-5-nitro-1,2,4-triazol-3-yl)benzimidazole (CAS 74245-89-9) is a chemical compound with molecular formula C10H8N6O2 and molecular weight 244.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-methyl-5-nitro-1,2,4-triazol-3-yl)benzimidazole
Also Known As: BAS 04238291, 1-(2-methyl-5-nitro-1,2,4-triazol-3-yl)benzimidazole, 1-(1-methyl-3-nitro-1H-1,2,4-triazol-5-yl)-1H-benzimidazole, 1-(1-methyl-3-nitro-1H-1,2,4-triazol-5-yl)-1H-benzo[d]imidazole, 1-(2-Methyl-5-nitro-2H-[1,2,4]triazol-3-yl)-1H-benzoimidazole
| Molecular Formula | C10H8N6O2 |
|---|---|
| Molecular Weight | 244.07 g/mol |
| LogP | 1.0622 |
| Topological Polar Surface Area | 91.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 244.07088 |
| Heavy Atoms | 18 |
| Complexity | 743.7487 |
Chemical Identifiers
| CAS Number | 74245-89-9 |
|---|---|
| SMILES | CN1C(=NC(=N1)[N+](=O)[O-])N2C=NC3=CC=CC=C32 |
Product Overview
1-(2-Methyl-5-nitro-1,2,4-triazol-3-yl)benzimidazole (CAS 74245-89-9), with molecular formula C10H8N6O2 and molecular weight 244.07 g/mol. IUPAC: 1-(2-methyl-5-nitro-1,2,4-triazol-3-yl)benzimidazole.
Chemical Property Profile of 1-(2-Methyl-5-nitro-1,2,4-triazol-3-yl)benzimidazole
Property Insights of 1-(2-Methyl-5-nitro-1,2,4-triazol-3-yl)benzimidazole
The XLogP value of 1.0622 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Methyl-5-nitro-1,2,4-triazol-3-yl)benzimidazole. The TPSA of 91.67 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-Methyl-5-nitro-1,2,4-triazol-3-yl)benzimidazole. Following Lipinski's Rule of Five, 1-(2-Methyl-5-nitro-1,2,4-triazol-3-yl)benzimidazole has 0 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 1-(2-Methyl-5-nitro-1,2,4-triazol-3-yl)benzimidazole?
The CAS number of 1-(2-Methyl-5-nitro-1,2,4-triazol-3-yl)benzimidazole is 74245-89-9.
What is the molecular formula of 1-(2-Methyl-5-nitro-1,2,4-triazol-3-yl)benzimidazole?
The molecular formula of 1-(2-Methyl-5-nitro-1,2,4-triazol-3-yl)benzimidazole is C10H8N6O2.
What is the molecular weight of 1-(2-Methyl-5-nitro-1,2,4-triazol-3-yl)benzimidazole?
The molecular weight of 1-(2-Methyl-5-nitro-1,2,4-triazol-3-yl)benzimidazole is 244.07 g/mol.
Where can I buy 1-(2-Methyl-5-nitro-1,2,4-triazol-3-yl)benzimidazole?
You can request a quote for 1-(2-Methyl-5-nitro-1,2,4-triazol-3-yl)benzimidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Methyl-5-nitro-1,2,4-triazol-3-yl)benzimidazole?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Methyl-5-nitro-1,2,4-triazol-3-yl)benzimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.