3-cyano-N,N-diethylbenzenesulfonamide
TL;DR: 3-cyano-N,N-diethylbenzenesulfonamide (CAS 860515-67-9) is a chemical compound with molecular formula C11H14N2O2S and molecular weight 238.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-cyano-N,N-diethylbenzenesulfonamide
Also Known As: 3-cyano-N,N-diethylbenzenesulfonamide, BNP?d-Biotin p-nitrophenyl ester, 3-Cyano-N,N-diethylbenzene-1-sulfonamide, Benzenesulfonamide, 3-cyano-N,N-diethyl-, RefChem:278705
| Molecular Formula | C11H14N2O2S |
|---|---|
| Molecular Weight | 238.08 g/mol |
| LogP | 1.58878 |
| Topological Polar Surface Area | 61.17 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 238.0776 |
| Heavy Atoms | 16 |
| Complexity | 498.961 |
Chemical Identifiers
| CAS Number | 860515-67-9 |
|---|---|
| SMILES | CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C#N |
Product Overview
3-cyano-N,N-diethylbenzenesulfonamide (CAS 860515-67-9), with molecular formula C11H14N2O2S and molecular weight 238.08 g/mol. IUPAC: 3-cyano-N,N-diethylbenzenesulfonamide.
Chemical Property Profile of 3-cyano-N,N-diethylbenzenesulfonamide
Property Insights of 3-cyano-N,N-diethylbenzenesulfonamide
The XLogP value of 1.58878 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-cyano-N,N-diethylbenzenesulfonamide. The TPSA of 61.17 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-cyano-N,N-diethylbenzenesulfonamide. Following Lipinski's Rule of Five, 3-cyano-N,N-diethylbenzenesulfonamide 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 3-cyano-N,N-diethylbenzenesulfonamide?
The CAS number of 3-cyano-N,N-diethylbenzenesulfonamide is 860515-67-9.
What is the molecular formula of 3-cyano-N,N-diethylbenzenesulfonamide?
The molecular formula of 3-cyano-N,N-diethylbenzenesulfonamide is C11H14N2O2S.
What is the molecular weight of 3-cyano-N,N-diethylbenzenesulfonamide?
The molecular weight of 3-cyano-N,N-diethylbenzenesulfonamide is 238.08 g/mol.
Where can I buy 3-cyano-N,N-diethylbenzenesulfonamide?
You can request a quote for 3-cyano-N,N-diethylbenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-cyano-N,N-diethylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 3-cyano-N,N-diethylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.