4-(2,2-dicyanoethenylamino)-N,N-dimethylbenzenesulfonamide
TL;DR: 4-(2,2-dicyanoethenylamino)-N,N-dimethylbenzenesulfonamide (CAS 852167-05-6) is a chemical compound with molecular formula C12H12N4O2S and molecular weight 276.06808 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(2,2-dicyanoethenylamino)-N,N-dimethylbenzenesulfonamide
Also Known As: 4-(2,2-dicyanoethenylamino)-N,N-dimethylbenzenesulfonamide, 4-[(2,2-Dicyanoethenyl)amino]-N,N-dimethylbenzene-1-sulfonamide
Technical Specifications
| Molecular Formula | C12H12N4O2S |
| Molecular Weight | 276.06808 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 105.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 276.06808 Da |
| Heavy Atoms | 19 |
| Complexity | 515.0 |
| SMILES | CN(C)S(=O)(=O)C1=CC=C(C=C1)NC=C(C#N)C#N |
| InChIKey | ABFKJDQCEQCOJD-UHFFFAOYSA-N |
Chemical Property Profile of 4-(2,2-dicyanoethenylamino)-N,N-dimethylbenzenesulfonamide
Property Insights of 4-(2,2-dicyanoethenylamino)-N,N-dimethylbenzenesulfonamide
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2,2-dicyanoethenylamino)-N,N-dimethylbenzenesulfonamide. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2,2-dicyanoethenylamino)-N,N-dimethylbenzenesulfonamide. Following Lipinski's Rule of Five, 4-(2,2-dicyanoethenylamino)-N,N-dimethylbenzenesulfonamide has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-(2,2-dicyanoethenylamino)-N,N-dimethylbenzenesulfonamide?
The CAS number of 4-(2,2-dicyanoethenylamino)-N,N-dimethylbenzenesulfonamide is 852167-05-6.
What is the molecular formula of 4-(2,2-dicyanoethenylamino)-N,N-dimethylbenzenesulfonamide?
The molecular formula of 4-(2,2-dicyanoethenylamino)-N,N-dimethylbenzenesulfonamide is C12H12N4O2S.
What is the molecular weight of 4-(2,2-dicyanoethenylamino)-N,N-dimethylbenzenesulfonamide?
The molecular weight of 4-(2,2-dicyanoethenylamino)-N,N-dimethylbenzenesulfonamide is 276.06808 g/mol.
Where can I buy 4-(2,2-dicyanoethenylamino)-N,N-dimethylbenzenesulfonamide?
You can request a quote for 4-(2,2-dicyanoethenylamino)-N,N-dimethylbenzenesulfonamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(2,2-dicyanoethenylamino)-N,N-dimethylbenzenesulfonamide?
Yes, CoreyChem provides custom synthesis services for 4-(2,2-dicyanoethenylamino)-N,N-dimethylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.