1-(2-Chloro-5-nitrophenyl)sulfonylimidazole
TL;DR: 1-(2-Chloro-5-nitrophenyl)sulfonylimidazole (CAS 625409-38-3) is a chemical compound with molecular formula C9H6ClN3O4S and molecular weight 286.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-chloro-5-nitrophenyl)sulfonylimidazole
Also Known As: 1-(2-chloro-5-nitrophenyl)sulfonylimidazole, 1-(2-chloro-5-nitrobenzenesulfonyl)-1H-imidazole, BAS 00804415, 1-((2-chloro-5-nitrophenyl)sulfonyl)-1H-imidazole, 1-chloro-2-(imidazolylsulfonyl)-4-nitrobenzene
| Molecular Formula | C9H6ClN3O4S |
|---|---|
| Molecular Weight | 286.98 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 106.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 286.97675 |
| Heavy Atoms | 18 |
| Complexity | 419.0 |
Chemical Identifiers
| CAS Number | 625409-38-3 |
|---|---|
| SMILES | C1=CC(=C(C=C1[N+](=O)[O-])S(=O)(=O)N2C=CN=C2)Cl |
| InChIKey | QKRWTWOKMZUUMD-UHFFFAOYSA-N |
Product Overview
1-(2-Chloro-5-nitrophenyl)sulfonylimidazole (CAS 625409-38-3), with molecular formula C9H6ClN3O4S and molecular weight 286.98 g/mol. IUPAC: 1-(2-chloro-5-nitrophenyl)sulfonylimidazole.
Chemical Property Profile of 1-(2-Chloro-5-nitrophenyl)sulfonylimidazole
Property Insights of 1-(2-Chloro-5-nitrophenyl)sulfonylimidazole
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Chloro-5-nitrophenyl)sulfonylimidazole. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-Chloro-5-nitrophenyl)sulfonylimidazole. Following Lipinski's Rule of Five, 1-(2-Chloro-5-nitrophenyl)sulfonylimidazole 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 1-(2-Chloro-5-nitrophenyl)sulfonylimidazole?
The CAS number of 1-(2-Chloro-5-nitrophenyl)sulfonylimidazole is 625409-38-3.
What is the molecular formula of 1-(2-Chloro-5-nitrophenyl)sulfonylimidazole?
The molecular formula of 1-(2-Chloro-5-nitrophenyl)sulfonylimidazole is C9H6ClN3O4S.
What is the molecular weight of 1-(2-Chloro-5-nitrophenyl)sulfonylimidazole?
The molecular weight of 1-(2-Chloro-5-nitrophenyl)sulfonylimidazole is 286.98 g/mol.
Where can I buy 1-(2-Chloro-5-nitrophenyl)sulfonylimidazole?
You can request a quote for 1-(2-Chloro-5-nitrophenyl)sulfonylimidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Chloro-5-nitrophenyl)sulfonylimidazole?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Chloro-5-nitrophenyl)sulfonylimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.