1H-Benzimidazole, 6-(methylsulfonyl)-4-nitro-2-(trifluoromethyl)-
TL;DR: 1H-Benzimidazole, 6-(methylsulfonyl)-4-nitro-2-(trifluoromethyl)- (CAS 19360-16-8) is a chemical compound with molecular formula C9H6F3N3O4S and molecular weight 309.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methylsulfonyl-4-nitro-2-(trifluoromethyl)-1H-benzimidazole
Also Known As: 1H-Benzimidazole, 6-(methylsulfonyl)-4-nitro-2-(trifluoromethyl)-, 6-methylsulfonyl-4-nitro-2-(trifluoromethyl)-1H-benzimidazole, 6-methylsulfonyl-4-nitro-2-(trifluoromethyl)-1H-benzoimidazole, 6-(Methanesulfonyl)-4-nitro-2-(trifluoromethyl)-1H-1,3-benzimidazole
| Molecular Formula | C9H6F3N3O4S |
|---|---|
| Molecular Weight | 309.00 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 117.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 1 |
| Exact Mass | 309.0031 |
| Heavy Atoms | 20 |
| Complexity | 498.0 |
Chemical Identifiers
| CAS Number | 19360-16-8 |
|---|---|
| SMILES | CS(=O)(=O)C1=CC2=C(C(=C1)[N+](=O)[O-])N=C(N2)C(F)(F)F |
| InChIKey | SCOVFLNBAGSELP-UHFFFAOYSA-N |
Product Overview
1H-Benzimidazole, 6-(methylsulfonyl)-4-nitro-2-(trifluoromethyl)- (CAS 19360-16-8), with molecular formula C9H6F3N3O4S and molecular weight 309.00 g/mol. IUPAC: 6-methylsulfonyl-4-nitro-2-(trifluoromethyl)-1H-benzimidazole.
Chemical Property Profile of 1H-Benzimidazole, 6-(methylsulfonyl)-4-nitro-2-(trifluoromethyl)-
Property Insights of 1H-Benzimidazole, 6-(methylsulfonyl)-4-nitro-2-(trifluoromethyl)-
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Benzimidazole, 6-(methylsulfonyl)-4-nitro-2-(trifluoromethyl)-. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Benzimidazole, 6-(methylsulfonyl)-4-nitro-2-(trifluoromethyl)-. Following Lipinski's Rule of Five, 1H-Benzimidazole, 6-(methylsulfonyl)-4-nitro-2-(trifluoromethyl)- has 1 hydrogen bond donor(s) and 8 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 1H-Benzimidazole, 6-(methylsulfonyl)-4-nitro-2-(trifluoromethyl)-?
The CAS number of 1H-Benzimidazole, 6-(methylsulfonyl)-4-nitro-2-(trifluoromethyl)- is 19360-16-8.
What is the molecular formula of 1H-Benzimidazole, 6-(methylsulfonyl)-4-nitro-2-(trifluoromethyl)-?
The molecular formula of 1H-Benzimidazole, 6-(methylsulfonyl)-4-nitro-2-(trifluoromethyl)- is C9H6F3N3O4S.
What is the molecular weight of 1H-Benzimidazole, 6-(methylsulfonyl)-4-nitro-2-(trifluoromethyl)-?
The molecular weight of 1H-Benzimidazole, 6-(methylsulfonyl)-4-nitro-2-(trifluoromethyl)- is 309.00 g/mol.
Where can I buy 1H-Benzimidazole, 6-(methylsulfonyl)-4-nitro-2-(trifluoromethyl)-?
You can request a quote for 1H-Benzimidazole, 6-(methylsulfonyl)-4-nitro-2-(trifluoromethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Benzimidazole, 6-(methylsulfonyl)-4-nitro-2-(trifluoromethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Benzimidazole, 6-(methylsulfonyl)-4-nitro-2-(trifluoromethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.