2-(2-Chloro-4-nitrophenyl)sulfanyl-1-methylimidazole
TL;DR: 2-(2-Chloro-4-nitrophenyl)sulfanyl-1-methylimidazole (CAS 133303-87-4) is a chemical compound with molecular formula C10H8ClN3O2S and molecular weight 269.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-chloro-4-nitrophenyl)sulfanyl-1-methylimidazole
Also Known As: 2-(2-chloro-4-nitrophenyl)sulfanyl-1-methylimidazole, 2-({2-chloro-4-nitrophenyl}sulfanyl)-1-methyl-1H-imidazole, AI-204/31685051, 2-chloro-4-nitrophenyl 1-methylimidazol-2-yl sulphide, 2-(2-chloro-4-nitro-phenylsulfanyl)-1-methyl-1H-imidazole
| Molecular Formula | C10H8ClN3O2S |
|---|---|
| Molecular Weight | 269.00 g/mol |
| LogP | 3.1329 |
| Topological Polar Surface Area | 60.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 269.00256 |
| Heavy Atoms | 17 |
| Complexity | 570.4287 |
Chemical Identifiers
| CAS Number | 133303-87-4 |
|---|---|
| SMILES | CN1C=CN=C1SC2=C(C=C(C=C2)[N+](=O)[O-])Cl |
Product Overview
2-(2-Chloro-4-nitrophenyl)sulfanyl-1-methylimidazole (CAS 133303-87-4), with molecular formula C10H8ClN3O2S and molecular weight 269.00 g/mol. IUPAC: 2-(2-chloro-4-nitrophenyl)sulfanyl-1-methylimidazole.
Chemical Property Profile of 2-(2-Chloro-4-nitrophenyl)sulfanyl-1-methylimidazole
Property Insights of 2-(2-Chloro-4-nitrophenyl)sulfanyl-1-methylimidazole
The XLogP value of 3.1329 indicates that 2-(2-Chloro-4-nitrophenyl)sulfanyl-1-methylimidazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.96 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-Chloro-4-nitrophenyl)sulfanyl-1-methylimidazole. Following Lipinski's Rule of Five, 2-(2-Chloro-4-nitrophenyl)sulfanyl-1-methylimidazole has 0 hydrogen bond donor(s) and 4 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-Chloro-4-nitrophenyl)sulfanyl-1-methylimidazole?
The CAS number of 2-(2-Chloro-4-nitrophenyl)sulfanyl-1-methylimidazole is 133303-87-4.
What is the molecular formula of 2-(2-Chloro-4-nitrophenyl)sulfanyl-1-methylimidazole?
The molecular formula of 2-(2-Chloro-4-nitrophenyl)sulfanyl-1-methylimidazole is C10H8ClN3O2S.
What is the molecular weight of 2-(2-Chloro-4-nitrophenyl)sulfanyl-1-methylimidazole?
The molecular weight of 2-(2-Chloro-4-nitrophenyl)sulfanyl-1-methylimidazole is 269.00 g/mol.
Where can I buy 2-(2-Chloro-4-nitrophenyl)sulfanyl-1-methylimidazole?
You can request a quote for 2-(2-Chloro-4-nitrophenyl)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-Chloro-4-nitrophenyl)sulfanyl-1-methylimidazole?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Chloro-4-nitrophenyl)sulfanyl-1-methylimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.