Imidazole, 2-(ethylsulfonylmethyl)-1-methyl-5-nitro-
TL;DR: Imidazole, 2-(ethylsulfonylmethyl)-1-methyl-5-nitro- (CAS 55138-64-2) is a chemical compound with molecular formula C7H11N3O4S and molecular weight 233.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(ethylsulfonylmethyl)-1-methyl-5-nitroimidazole
Also Known As: 2-(Ethylsulfonylmethyl)-1-methyl-5-nitroimidazole, Imidazole, 2-(ethylsulfonylmethyl)-1-methyl-5-nitro-, 5-23-10-00559 (Beilstein Handbook Reference), 2-Ethanesulfonylmethyl-1-methyl-5-nitro-1H-imidazole, 2-[(ethanesulfonyl)methyl]-1-methyl-5-nitro-1H-imidazole
| Molecular Formula | C7H11N3O4S |
|---|---|
| Molecular Weight | 233.05 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 106.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 233.04703 |
| Heavy Atoms | 15 |
| Complexity | 331.0 |
Chemical Identifiers
| CAS Number | 55138-64-2 |
|---|---|
| SMILES | CCS(=O)(=O)CC1=NC=C(N1C)[N+](=O)[O-] |
| InChIKey | WOJWXHGCKLIUQL-UHFFFAOYSA-N |
Product Overview
Imidazole, 2-(ethylsulfonylmethyl)-1-methyl-5-nitro- (CAS 55138-64-2), with molecular formula C7H11N3O4S and molecular weight 233.05 g/mol. IUPAC: 2-(ethylsulfonylmethyl)-1-methyl-5-nitroimidazole.
Chemical Property Profile of Imidazole, 2-(ethylsulfonylmethyl)-1-methyl-5-nitro-
Property Insights of Imidazole, 2-(ethylsulfonylmethyl)-1-methyl-5-nitro-
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Imidazole, 2-(ethylsulfonylmethyl)-1-methyl-5-nitro-. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Imidazole, 2-(ethylsulfonylmethyl)-1-methyl-5-nitro-. Following Lipinski's Rule of Five, Imidazole, 2-(ethylsulfonylmethyl)-1-methyl-5-nitro- 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 Imidazole, 2-(ethylsulfonylmethyl)-1-methyl-5-nitro-?
The CAS number of Imidazole, 2-(ethylsulfonylmethyl)-1-methyl-5-nitro- is 55138-64-2.
What is the molecular formula of Imidazole, 2-(ethylsulfonylmethyl)-1-methyl-5-nitro-?
The molecular formula of Imidazole, 2-(ethylsulfonylmethyl)-1-methyl-5-nitro- is C7H11N3O4S.
What is the molecular weight of Imidazole, 2-(ethylsulfonylmethyl)-1-methyl-5-nitro-?
The molecular weight of Imidazole, 2-(ethylsulfonylmethyl)-1-methyl-5-nitro- is 233.05 g/mol.
Where can I buy Imidazole, 2-(ethylsulfonylmethyl)-1-methyl-5-nitro-?
You can request a quote for Imidazole, 2-(ethylsulfonylmethyl)-1-methyl-5-nitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Imidazole, 2-(ethylsulfonylmethyl)-1-methyl-5-nitro-?
Yes, KEHONG BIO provides custom synthesis services for Imidazole, 2-(ethylsulfonylmethyl)-1-methyl-5-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.