2-Amino-6-(3,5-dimethylphenyl)sulfonylbenzonitrile
TL;DR: 2-Amino-6-(3,5-dimethylphenyl)sulfonylbenzonitrile (CAS 171102-55-9) is a chemical compound with molecular formula C15H14N2O2S and molecular weight 286.0776 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-amino-6-(3,5-dimethylphenyl)sulfonylbenzonitrile
Also Known As: 1jlq, 2-amino-6-(3,5-dimethylphenyl)sulfonylbenzonitrile, 739W94, 2-amino-6-(3,5-dimethylbenzenesulfonyl)benzonitrile, J2.035.053I
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C15H14N2O2S |
| Molecular Weight | 286.0776 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 92.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 286.0776 Da |
| Heavy Atoms | 20 |
| Complexity | 478.0 |
| SMILES | CC1=CC(=CC(=C1)S(=O)(=O)C2=CC=CC(=C2C#N)N)C |
| InChIKey | SWGDXLAZBZDUBR-UHFFFAOYSA-N |
Product Description
Applications: 2-Amino-6-(3,5-dimethylphenyl)sulfonylbenzonitrile is used in complex organic molecule assembly across discovery and process chemistry, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 2-Amino-6-(3,5-dimethylphenyl)sulfonylbenzonitrile (CAS 171102-55-9) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
2-Amino-6-(3,5-dimethylphenyl)sulfonylbenzonitrile (CAS 171102-55-9) is a organic building block with the molecular formula C15H14N2O2S and a molecular weight of 286.08 g/mol. It is also known as 1jlq and 2-amino-6-(3,5-dimethylphenyl)sulfonylbenzonitrile.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 2-Amino-6-(3,5-dimethylphenyl)sulfonylbenzonitrile
Property Insights of 2-Amino-6-(3,5-dimethylphenyl)sulfonylbenzonitrile
The XLogP value of 3.0 indicates that 2-Amino-6-(3,5-dimethylphenyl)sulfonylbenzonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Amino-6-(3,5-dimethylphenyl)sulfonylbenzonitrile. Following Lipinski's Rule of Five, 2-Amino-6-(3,5-dimethylphenyl)sulfonylbenzonitrile has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Amino-6-(3,5-dimethylphenyl)sulfonylbenzonitrile?
The CAS number of 2-Amino-6-(3,5-dimethylphenyl)sulfonylbenzonitrile is 171102-55-9.
What is the molecular formula of 2-Amino-6-(3,5-dimethylphenyl)sulfonylbenzonitrile?
The molecular formula of 2-Amino-6-(3,5-dimethylphenyl)sulfonylbenzonitrile is C15H14N2O2S.
What is the molecular weight of 2-Amino-6-(3,5-dimethylphenyl)sulfonylbenzonitrile?
The molecular weight of 2-Amino-6-(3,5-dimethylphenyl)sulfonylbenzonitrile is 286.0776 g/mol.
What are the applications of 2-Amino-6-(3,5-dimethylphenyl)sulfonylbenzonitrile?
2-Amino-6-(3,5-dimethylphenyl)sulfonylbenzonitrile is used in complex organic molecule assembly across discovery and process chemistry, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies...
Where can I buy 2-Amino-6-(3,5-dimethylphenyl)sulfonylbenzonitrile?
You can request a quote for 2-Amino-6-(3,5-dimethylphenyl)sulfonylbenzonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Amino-6-(3,5-dimethylphenyl)sulfonylbenzonitrile?
Yes, CoreyChem provides custom synthesis services for 2-Amino-6-(3,5-dimethylphenyl)sulfonylbenzonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.