2-(2,4-Dinitrophenyl)sulfanyl-1-methylimidazole
TL;DR: 2-(2,4-Dinitrophenyl)sulfanyl-1-methylimidazole (CAS 87008-54-6) is a chemical compound with molecular formula C10H8N4O4S and molecular weight 280.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,4-dinitrophenyl)sulfanyl-1-methylimidazole
Also Known As: 1-methyl-2-(2,4-dinitrophenylmercapto)imidazole
| Molecular Formula | C10H8N4O4S |
|---|---|
| Molecular Weight | 280.03 g/mol |
| LogP | 2.3877 |
| Topological Polar Surface Area | 104.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 280.0266 |
| Heavy Atoms | 19 |
| Complexity | 654.72925 |
Chemical Identifiers
| CAS Number | 87008-54-6 |
|---|---|
| SMILES | CN1C=CN=C1SC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
2-(2,4-Dinitrophenyl)sulfanyl-1-methylimidazole (CAS 87008-54-6), with molecular formula C10H8N4O4S and molecular weight 280.03 g/mol. IUPAC: 2-(2,4-dinitrophenyl)sulfanyl-1-methylimidazole.
Chemical Property Profile of 2-(2,4-Dinitrophenyl)sulfanyl-1-methylimidazole
Property Insights of 2-(2,4-Dinitrophenyl)sulfanyl-1-methylimidazole
The XLogP value of 2.3877 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2,4-Dinitrophenyl)sulfanyl-1-methylimidazole. The TPSA of 104.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2,4-Dinitrophenyl)sulfanyl-1-methylimidazole. Following Lipinski's Rule of Five, 2-(2,4-Dinitrophenyl)sulfanyl-1-methylimidazole 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 2-(2,4-Dinitrophenyl)sulfanyl-1-methylimidazole?
The CAS number of 2-(2,4-Dinitrophenyl)sulfanyl-1-methylimidazole is 87008-54-6.
What is the molecular formula of 2-(2,4-Dinitrophenyl)sulfanyl-1-methylimidazole?
The molecular formula of 2-(2,4-Dinitrophenyl)sulfanyl-1-methylimidazole is C10H8N4O4S.
What is the molecular weight of 2-(2,4-Dinitrophenyl)sulfanyl-1-methylimidazole?
The molecular weight of 2-(2,4-Dinitrophenyl)sulfanyl-1-methylimidazole is 280.03 g/mol.
Where can I buy 2-(2,4-Dinitrophenyl)sulfanyl-1-methylimidazole?
You can request a quote for 2-(2,4-Dinitrophenyl)sulfanyl-1-methylimidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2,4-Dinitrophenyl)sulfanyl-1-methylimidazole?
Yes, KEHONG BIO provides custom synthesis services for 2-(2,4-Dinitrophenyl)sulfanyl-1-methylimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.