1-(2,4,5-trichlorobenzenesulfonyl)-1H-1,3-benzodiazole
TL;DR: 1-(2,4,5-trichlorobenzenesulfonyl)-1H-1,3-benzodiazole (CAS 325813-98-7) is a chemical compound with molecular formula C13H7Cl3N2O2S and molecular weight 359.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,4,5-trichlorophenyl)sulfonylbenzimidazole
Also Known As: 1-(2,4,5-trichlorophenyl)sulfonylbenzimidazole, 1-(benzimidazolylsulfonyl)-2,4,5-trichlorobenzene, 1-(2,4,5-trichlorobenzenesulfonyl)-1H-1,3-benzodiazole, 1-[(2,4,5-trichlorophenyl)sulfonyl]-1H-benzimidazole
| Molecular Formula | C13H7Cl3N2O2S |
|---|---|
| Molecular Weight | 359.93 g/mol |
| LogP | 4.2335 |
| Topological Polar Surface Area | 51.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 359.92938 |
| Heavy Atoms | 21 |
| Complexity | 951.20483 |
Chemical Identifiers
| CAS Number | 325813-98-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=CN2S(=O)(=O)C3=CC(=C(C=C3Cl)Cl)Cl |
Product Overview
1-(2,4,5-trichlorobenzenesulfonyl)-1H-1,3-benzodiazole (CAS 325813-98-7), with molecular formula C13H7Cl3N2O2S and molecular weight 359.93 g/mol. IUPAC: 1-(2,4,5-trichlorophenyl)sulfonylbenzimidazole.
Chemical Property Profile of 1-(2,4,5-trichlorobenzenesulfonyl)-1H-1,3-benzodiazole
Property Insights of 1-(2,4,5-trichlorobenzenesulfonyl)-1H-1,3-benzodiazole
The XLogP value of 4.2335 indicates that 1-(2,4,5-trichlorobenzenesulfonyl)-1H-1,3-benzodiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.96 Ų, 1-(2,4,5-trichlorobenzenesulfonyl)-1H-1,3-benzodiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2,4,5-trichlorobenzenesulfonyl)-1H-1,3-benzodiazole has 0 hydrogen bond donor(s) and 3 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-(2,4,5-trichlorobenzenesulfonyl)-1H-1,3-benzodiazole?
The CAS number of 1-(2,4,5-trichlorobenzenesulfonyl)-1H-1,3-benzodiazole is 325813-98-7.
What is the molecular formula of 1-(2,4,5-trichlorobenzenesulfonyl)-1H-1,3-benzodiazole?
The molecular formula of 1-(2,4,5-trichlorobenzenesulfonyl)-1H-1,3-benzodiazole is C13H7Cl3N2O2S.
What is the molecular weight of 1-(2,4,5-trichlorobenzenesulfonyl)-1H-1,3-benzodiazole?
The molecular weight of 1-(2,4,5-trichlorobenzenesulfonyl)-1H-1,3-benzodiazole is 359.93 g/mol.
Where can I buy 1-(2,4,5-trichlorobenzenesulfonyl)-1H-1,3-benzodiazole?
You can request a quote for 1-(2,4,5-trichlorobenzenesulfonyl)-1H-1,3-benzodiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2,4,5-trichlorobenzenesulfonyl)-1H-1,3-benzodiazole?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,4,5-trichlorobenzenesulfonyl)-1H-1,3-benzodiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.