1-(2,4-dichloro-5-methylbenzenesulfonyl)-1H-1,2,3-benzotriazole
TL;DR: 1-(2,4-dichloro-5-methylbenzenesulfonyl)-1H-1,2,3-benzotriazole (CAS 325812-27-9) is a chemical compound with molecular formula C13H9Cl2N3O2S and molecular weight 340.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,4-dichloro-5-methylphenyl)sulfonylbenzotriazole
Also Known As: ChemDiv1_026100, 1-(2,4-dichloro-5-methylbenzenesulfonyl)-1H-1,2,3-benzotriazole, 1-(2,4-dichloro-5-methylphenyl)sulfonylbenzotriazole, 1-(benzotriazolylsulfonyl)-2,4-dichloro-5-methylbenzene, 1-[(2,4-dichloro-5-methylphenyl)sulfonyl]-1H-1,2,3-benzotriazole
| Molecular Formula | C13H9Cl2N3O2S |
|---|---|
| Molecular Weight | 340.98 g/mol |
| LogP | 3.28352 |
| Topological Polar Surface Area | 64.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 340.97925 |
| Heavy Atoms | 21 |
| Complexity | 951.20483 |
Chemical Identifiers
| CAS Number | 325812-27-9 |
|---|---|
| SMILES | CC1=CC(=C(C=C1Cl)Cl)S(=O)(=O)N2C3=CC=CC=C3N=N2 |
Product Overview
1-(2,4-dichloro-5-methylbenzenesulfonyl)-1H-1,2,3-benzotriazole (CAS 325812-27-9), with molecular formula C13H9Cl2N3O2S and molecular weight 340.98 g/mol. IUPAC: 1-(2,4-dichloro-5-methylphenyl)sulfonylbenzotriazole.
Chemical Property Profile of 1-(2,4-dichloro-5-methylbenzenesulfonyl)-1H-1,2,3-benzotriazole
Property Insights of 1-(2,4-dichloro-5-methylbenzenesulfonyl)-1H-1,2,3-benzotriazole
The XLogP value of 3.28352 indicates that 1-(2,4-dichloro-5-methylbenzenesulfonyl)-1H-1,2,3-benzotriazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.85 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2,4-dichloro-5-methylbenzenesulfonyl)-1H-1,2,3-benzotriazole. Following Lipinski's Rule of Five, 1-(2,4-dichloro-5-methylbenzenesulfonyl)-1H-1,2,3-benzotriazole 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 1-(2,4-dichloro-5-methylbenzenesulfonyl)-1H-1,2,3-benzotriazole?
The CAS number of 1-(2,4-dichloro-5-methylbenzenesulfonyl)-1H-1,2,3-benzotriazole is 325812-27-9.
What is the molecular formula of 1-(2,4-dichloro-5-methylbenzenesulfonyl)-1H-1,2,3-benzotriazole?
The molecular formula of 1-(2,4-dichloro-5-methylbenzenesulfonyl)-1H-1,2,3-benzotriazole is C13H9Cl2N3O2S.
What is the molecular weight of 1-(2,4-dichloro-5-methylbenzenesulfonyl)-1H-1,2,3-benzotriazole?
The molecular weight of 1-(2,4-dichloro-5-methylbenzenesulfonyl)-1H-1,2,3-benzotriazole is 340.98 g/mol.
Where can I buy 1-(2,4-dichloro-5-methylbenzenesulfonyl)-1H-1,2,3-benzotriazole?
You can request a quote for 1-(2,4-dichloro-5-methylbenzenesulfonyl)-1H-1,2,3-benzotriazole 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-dichloro-5-methylbenzenesulfonyl)-1H-1,2,3-benzotriazole?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,4-dichloro-5-methylbenzenesulfonyl)-1H-1,2,3-benzotriazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.