N-(cyanomethyl)-2,4,6-trimethylbenzenesulfonamide
TL;DR: N-(cyanomethyl)-2,4,6-trimethylbenzenesulfonamide (CAS 333430-05-0) 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.
N-(cyanomethyl)-2,4,6-trimethylbenzenesulfonamide
Also Known As: N-(cyanomethyl)-2,4,6-trimethylbenzenesulfonamide, BAS 00501436, BIM-0018860.P001, AB00082572-01, N-Cyanomethyl-2,4,6-trimethyl-benzenesulfonamide
| Molecular Formula | C11H14N2O2S |
|---|---|
| Molecular Weight | 238.08 g/mol |
| LogP | 1.41374 |
| Topological Polar Surface Area | 69.96 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 238.0776 |
| Heavy Atoms | 16 |
| Complexity | 518.5884 |
Chemical Identifiers
| CAS Number | 333430-05-0 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)C)S(=O)(=O)NCC#N)C |
Product Overview
N-(cyanomethyl)-2,4,6-trimethylbenzenesulfonamide (CAS 333430-05-0), with molecular formula C11H14N2O2S and molecular weight 238.08 g/mol. IUPAC: N-(cyanomethyl)-2,4,6-trimethylbenzenesulfonamide.
Chemical Property Profile of N-(cyanomethyl)-2,4,6-trimethylbenzenesulfonamide
Property Insights of N-(cyanomethyl)-2,4,6-trimethylbenzenesulfonamide
The XLogP value of 1.41374 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(cyanomethyl)-2,4,6-trimethylbenzenesulfonamide. The TPSA of 69.96 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(cyanomethyl)-2,4,6-trimethylbenzenesulfonamide. Following Lipinski's Rule of Five, N-(cyanomethyl)-2,4,6-trimethylbenzenesulfonamide has 1 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 N-(cyanomethyl)-2,4,6-trimethylbenzenesulfonamide?
The CAS number of N-(cyanomethyl)-2,4,6-trimethylbenzenesulfonamide is 333430-05-0.
What is the molecular formula of N-(cyanomethyl)-2,4,6-trimethylbenzenesulfonamide?
The molecular formula of N-(cyanomethyl)-2,4,6-trimethylbenzenesulfonamide is C11H14N2O2S.
What is the molecular weight of N-(cyanomethyl)-2,4,6-trimethylbenzenesulfonamide?
The molecular weight of N-(cyanomethyl)-2,4,6-trimethylbenzenesulfonamide is 238.08 g/mol.
Where can I buy N-(cyanomethyl)-2,4,6-trimethylbenzenesulfonamide?
You can request a quote for N-(cyanomethyl)-2,4,6-trimethylbenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(cyanomethyl)-2,4,6-trimethylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-(cyanomethyl)-2,4,6-trimethylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.