N-Cyanomethyl-4-methyl-benzenesulfonamide
TL;DR: N-Cyanomethyl-4-methyl-benzenesulfonamide (CAS 20228-87-9) is a chemical compound with molecular formula C9H10N2O2S and molecular weight 210.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(cyanomethyl)-4-methylbenzenesulfonamide
Also Known As: N-(cyanomethyl)-4-methylbenzenesulfonamide, N-Cyanomethyl-4-methyl-benzenesulfonamide, N-(cyanomethyl)-4-methylbenzene-1-sulfonamide, N-Cyanomethyl-4-methylbenzenesulfonamide, BAS 00624973
| Molecular Formula | C9H10N2O2S |
|---|---|
| Molecular Weight | 210.05 g/mol |
| LogP | 0.7969 |
| Topological Polar Surface Area | 69.96 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 210.0463 |
| Heavy Atoms | 14 |
| Complexity | 442.69547 |
Chemical Identifiers
| CAS Number | 20228-87-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NCC#N |
Product Overview
N-Cyanomethyl-4-methyl-benzenesulfonamide (CAS 20228-87-9), with molecular formula C9H10N2O2S and molecular weight 210.05 g/mol. IUPAC: N-(cyanomethyl)-4-methylbenzenesulfonamide.
Chemical Property Profile of N-Cyanomethyl-4-methyl-benzenesulfonamide
Property Insights of N-Cyanomethyl-4-methyl-benzenesulfonamide
The XLogP value of 0.7969 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Cyanomethyl-4-methyl-benzenesulfonamide. The TPSA of 69.96 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Cyanomethyl-4-methyl-benzenesulfonamide. Following Lipinski's Rule of Five, N-Cyanomethyl-4-methyl-benzenesulfonamide 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-4-methyl-benzenesulfonamide?
The CAS number of N-Cyanomethyl-4-methyl-benzenesulfonamide is 20228-87-9.
What is the molecular formula of N-Cyanomethyl-4-methyl-benzenesulfonamide?
The molecular formula of N-Cyanomethyl-4-methyl-benzenesulfonamide is C9H10N2O2S.
What is the molecular weight of N-Cyanomethyl-4-methyl-benzenesulfonamide?
The molecular weight of N-Cyanomethyl-4-methyl-benzenesulfonamide is 210.05 g/mol.
Where can I buy N-Cyanomethyl-4-methyl-benzenesulfonamide?
You can request a quote for N-Cyanomethyl-4-methyl-benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Cyanomethyl-4-methyl-benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-Cyanomethyl-4-methyl-benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.