![1-Methyl-2-[(4-methylsulfonylpiperazin-1-yl)methyl]-5-nitrobenzimidazole structure](/static/products/895/895821-99-5.png)
1-Methyl-2-[(4-methylsulfonylpiperazin-1-yl)methyl]-5-nitrobenzimidazole
TL;DR: 1-Methyl-2-[(4-methylsulfonylpiperazin-1-yl)methyl]-5-nitrobenzimidazole (CAS 895821-99-5) is a chemical compound with molecular formula C14H19N5O4S and molecular weight 353.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-2-[(4-methylsulfonylpiperazin-1-yl)methyl]-5-nitrobenzimidazole
Also Known As: 1-methyl-2-[(4-methylsulfonylpiperazin-1-yl)methyl]-5-nitrobenzimidazole, 1-methyl-2-{[4-(methylsulfonyl)piperazin-1-yl]methyl}-5-nitro-1H-benzimidazole, 1-methyl-2-[(4-methylsulfonylpiperazin-1-yl)methyl]-5-nitro-benzoimidazole, 1-methyl-2-((4-(methylsulfonyl)piperazin-1-yl)methyl)-5-nitro-1H-benzo[d]imidazole
| Molecular Formula | C14H19N5O4S |
|---|---|
| Molecular Weight | 353.12 g/mol |
| LogP | 0.5587 |
| Topological Polar Surface Area | 101.58 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 353.11578 |
| Heavy Atoms | 24 |
| Complexity | 883.947 |
Chemical Identifiers
| CAS Number | 895821-99-5 |
|---|---|
| SMILES | CN1C2=C(C=C(C=C2)[N+](=O)[O-])N=C1CN3CCN(CC3)S(=O)(=O)C |
Product Overview
1-Methyl-2-[(4-methylsulfonylpiperazin-1-yl)methyl]-5-nitrobenzimidazole (CAS 895821-99-5), with molecular formula C14H19N5O4S and molecular weight 353.12 g/mol. IUPAC: 1-methyl-2-[(4-methylsulfonylpiperazin-1-yl)methyl]-5-nitrobenzimidazole.
Chemical Property Profile of 1-Methyl-2-[(4-methylsulfonylpiperazin-1-yl)methyl]-5-nitrobenzimidazole
Property Insights of 1-Methyl-2-[(4-methylsulfonylpiperazin-1-yl)methyl]-5-nitrobenzimidazole
The XLogP value of 0.5587 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methyl-2-[(4-methylsulfonylpiperazin-1-yl)methyl]-5-nitrobenzimidazole. The TPSA of 101.58 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Methyl-2-[(4-methylsulfonylpiperazin-1-yl)methyl]-5-nitrobenzimidazole. Following Lipinski's Rule of Five, 1-Methyl-2-[(4-methylsulfonylpiperazin-1-yl)methyl]-5-nitrobenzimidazole 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-[(4-methylsulfonylpiperazin-1-yl)methyl]-5-nitrobenzimidazole?
The CAS number of 1-Methyl-2-[(4-methylsulfonylpiperazin-1-yl)methyl]-5-nitrobenzimidazole is 895821-99-5.
What is the molecular formula of 1-Methyl-2-[(4-methylsulfonylpiperazin-1-yl)methyl]-5-nitrobenzimidazole?
The molecular formula of 1-Methyl-2-[(4-methylsulfonylpiperazin-1-yl)methyl]-5-nitrobenzimidazole is C14H19N5O4S.
What is the molecular weight of 1-Methyl-2-[(4-methylsulfonylpiperazin-1-yl)methyl]-5-nitrobenzimidazole?
The molecular weight of 1-Methyl-2-[(4-methylsulfonylpiperazin-1-yl)methyl]-5-nitrobenzimidazole is 353.12 g/mol.
Where can I buy 1-Methyl-2-[(4-methylsulfonylpiperazin-1-yl)methyl]-5-nitrobenzimidazole?
You can request a quote for 1-Methyl-2-[(4-methylsulfonylpiperazin-1-yl)methyl]-5-nitrobenzimidazole 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-[(4-methylsulfonylpiperazin-1-yl)methyl]-5-nitrobenzimidazole?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-2-[(4-methylsulfonylpiperazin-1-yl)methyl]-5-nitrobenzimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.