![1-Methyl-2-[(2-methyl-5-nitro-1,2,4-triazol-3-yl)sulfanyl]benzimidazole structure](/static/products/4614/461438-31-3.webp)
1-Methyl-2-[(2-methyl-5-nitro-1,2,4-triazol-3-yl)sulfanyl]benzimidazole
TL;DR: 1-Methyl-2-[(2-methyl-5-nitro-1,2,4-triazol-3-yl)sulfanyl]benzimidazole (CAS 461438-31-3) is a chemical compound with molecular formula C11H10N6O2S and molecular weight 290.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-2-[(2-methyl-5-nitro-1,2,4-triazol-3-yl)sulfanyl]benzimidazole
Also Known As: 1-methyl-2-[(2-methyl-5-nitro-1,2,4-triazol-3-yl)sulfanyl]benzimidazole, 1-methyl-2-[(1-methyl-3-nitro-1H-1,2,4-triazol-5-yl)sulfanyl]-1H-benzimidazole
| Molecular Formula | C11H10N6O2S |
|---|---|
| Molecular Weight | 290.06 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 120.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 290.0586 |
| Heavy Atoms | 20 |
| Complexity | 380.0 |
Chemical Identifiers
| CAS Number | 461438-31-3 |
|---|---|
| SMILES | CN1C2=CC=CC=C2N=C1SC3=NC(=NN3C)[N+](=O)[O-] |
| InChIKey | ZCNYFGQARSSVFK-UHFFFAOYSA-N |
Product Overview
1-Methyl-2-[(2-methyl-5-nitro-1,2,4-triazol-3-yl)sulfanyl]benzimidazole (CAS 461438-31-3), with molecular formula C11H10N6O2S and molecular weight 290.06 g/mol. IUPAC: 1-methyl-2-[(2-methyl-5-nitro-1,2,4-triazol-3-yl)sulfanyl]benzimidazole.
Chemical Property Profile of 1-Methyl-2-[(2-methyl-5-nitro-1,2,4-triazol-3-yl)sulfanyl]benzimidazole
Property Insights of 1-Methyl-2-[(2-methyl-5-nitro-1,2,4-triazol-3-yl)sulfanyl]benzimidazole
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methyl-2-[(2-methyl-5-nitro-1,2,4-triazol-3-yl)sulfanyl]benzimidazole. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Methyl-2-[(2-methyl-5-nitro-1,2,4-triazol-3-yl)sulfanyl]benzimidazole. Following Lipinski's Rule of Five, 1-Methyl-2-[(2-methyl-5-nitro-1,2,4-triazol-3-yl)sulfanyl]benzimidazole 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 1-Methyl-2-[(2-methyl-5-nitro-1,2,4-triazol-3-yl)sulfanyl]benzimidazole?
The CAS number of 1-Methyl-2-[(2-methyl-5-nitro-1,2,4-triazol-3-yl)sulfanyl]benzimidazole is 461438-31-3.
What is the molecular formula of 1-Methyl-2-[(2-methyl-5-nitro-1,2,4-triazol-3-yl)sulfanyl]benzimidazole?
The molecular formula of 1-Methyl-2-[(2-methyl-5-nitro-1,2,4-triazol-3-yl)sulfanyl]benzimidazole is C11H10N6O2S.
What is the molecular weight of 1-Methyl-2-[(2-methyl-5-nitro-1,2,4-triazol-3-yl)sulfanyl]benzimidazole?
The molecular weight of 1-Methyl-2-[(2-methyl-5-nitro-1,2,4-triazol-3-yl)sulfanyl]benzimidazole is 290.06 g/mol.
Where can I buy 1-Methyl-2-[(2-methyl-5-nitro-1,2,4-triazol-3-yl)sulfanyl]benzimidazole?
You can request a quote for 1-Methyl-2-[(2-methyl-5-nitro-1,2,4-triazol-3-yl)sulfanyl]benzimidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methyl-2-[(2-methyl-5-nitro-1,2,4-triazol-3-yl)sulfanyl]benzimidazole?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-2-[(2-methyl-5-nitro-1,2,4-triazol-3-yl)sulfanyl]benzimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.