1-(3,4-Dichlorophenyl)sulfonylbenzotriazole
TL;DR: 1-(3,4-Dichlorophenyl)sulfonylbenzotriazole (CAS 4255-95-2) is a chemical compound with molecular formula C12H7Cl2N3O2S and molecular weight 326.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,4-dichlorophenyl)sulfonylbenzotriazole
Also Known As: 1-(3,4-dichlorophenyl)sulfonylbenzotriazole, 1-(3,4-dichloro-benzenesulfonyl)-1H-benzotriazole, 4-(benzotriazolylsulfonyl)-1,2-dichlorobenzene, AF-399/14196384, 1-[(3,4-dichlorophenyl)sulfonyl]-1H-1,2,3-benzotriazole
| Molecular Formula | C12H7Cl2N3O2S |
|---|---|
| Molecular Weight | 326.96 g/mol |
| LogP | 2.9751 |
| Topological Polar Surface Area | 64.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 326.9636 |
| Heavy Atoms | 20 |
| Complexity | 905.96136 |
Chemical Identifiers
| CAS Number | 4255-95-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=NN2S(=O)(=O)C3=CC(=C(C=C3)Cl)Cl |
Product Overview
1-(3,4-Dichlorophenyl)sulfonylbenzotriazole (CAS 4255-95-2), with molecular formula C12H7Cl2N3O2S and molecular weight 326.96 g/mol. IUPAC: 1-(3,4-dichlorophenyl)sulfonylbenzotriazole.
Chemical Property Profile of 1-(3,4-Dichlorophenyl)sulfonylbenzotriazole
Property Insights of 1-(3,4-Dichlorophenyl)sulfonylbenzotriazole
The XLogP value of 2.9751 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3,4-Dichlorophenyl)sulfonylbenzotriazole. The TPSA of 64.85 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3,4-Dichlorophenyl)sulfonylbenzotriazole. Following Lipinski's Rule of Five, 1-(3,4-Dichlorophenyl)sulfonylbenzotriazole 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-(3,4-Dichlorophenyl)sulfonylbenzotriazole?
The CAS number of 1-(3,4-Dichlorophenyl)sulfonylbenzotriazole is 4255-95-2.
What is the molecular formula of 1-(3,4-Dichlorophenyl)sulfonylbenzotriazole?
The molecular formula of 1-(3,4-Dichlorophenyl)sulfonylbenzotriazole is C12H7Cl2N3O2S.
What is the molecular weight of 1-(3,4-Dichlorophenyl)sulfonylbenzotriazole?
The molecular weight of 1-(3,4-Dichlorophenyl)sulfonylbenzotriazole is 326.96 g/mol.
Where can I buy 1-(3,4-Dichlorophenyl)sulfonylbenzotriazole?
You can request a quote for 1-(3,4-Dichlorophenyl)sulfonylbenzotriazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3,4-Dichlorophenyl)sulfonylbenzotriazole?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,4-Dichlorophenyl)sulfonylbenzotriazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.