![(2-Cyanophenyl)methyl 2-[methyl-(4-methylphenyl)sulfonylamino]acetate structure](/static/products/5732/5732-63-8.webp)
(2-Cyanophenyl)methyl 2-[methyl-(4-methylphenyl)sulfonylamino]acetate
TL;DR: (2-Cyanophenyl)methyl 2-[methyl-(4-methylphenyl)sulfonylamino]acetate (CAS 5732-63-8) is a chemical compound with molecular formula C18H18N2O4S and molecular weight 358.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-cyanophenyl)methyl 2-[methyl-(4-methylphenyl)sulfonylamino]acetate
Also Known As: (2-cyanophenyl)methyl 2-[methyl-(4-methylphenyl)sulfonylamino]acetate, (2-Cyanophenyl)methyl N-methyl-N-(4-methylbenzene-1-sulfonyl)glycinate
| Molecular Formula | C18H18N2O4S |
|---|---|
| Molecular Weight | 358.10 g/mol |
| LogP | 2.2306 |
| Topological Polar Surface Area | 87.47 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 358.09872 |
| Heavy Atoms | 25 |
| Complexity | 899.41846 |
Chemical Identifiers
| CAS Number | 5732-63-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)OCC2=CC=CC=C2C#N |
Product Overview
(2-Cyanophenyl)methyl 2-[methyl-(4-methylphenyl)sulfonylamino]acetate (CAS 5732-63-8), with molecular formula C18H18N2O4S and molecular weight 358.10 g/mol. IUPAC: (2-cyanophenyl)methyl 2-[methyl-(4-methylphenyl)sulfonylamino]acetate.
Chemical Property Profile of (2-Cyanophenyl)methyl 2-[methyl-(4-methylphenyl)sulfonylamino]acetate
Property Insights of (2-Cyanophenyl)methyl 2-[methyl-(4-methylphenyl)sulfonylamino]acetate
The XLogP value of 2.2306 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2-Cyanophenyl)methyl 2-[methyl-(4-methylphenyl)sulfonylamino]acetate. The TPSA of 87.47 Ų falls within the moderate polarity range, balancing permeability and solubility for (2-Cyanophenyl)methyl 2-[methyl-(4-methylphenyl)sulfonylamino]acetate. Following Lipinski's Rule of Five, (2-Cyanophenyl)methyl 2-[methyl-(4-methylphenyl)sulfonylamino]acetate has 0 hydrogen bond donor(s) and 5 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 (2-Cyanophenyl)methyl 2-[methyl-(4-methylphenyl)sulfonylamino]acetate?
The CAS number of (2-Cyanophenyl)methyl 2-[methyl-(4-methylphenyl)sulfonylamino]acetate is 5732-63-8.
What is the molecular formula of (2-Cyanophenyl)methyl 2-[methyl-(4-methylphenyl)sulfonylamino]acetate?
The molecular formula of (2-Cyanophenyl)methyl 2-[methyl-(4-methylphenyl)sulfonylamino]acetate is C18H18N2O4S.
What is the molecular weight of (2-Cyanophenyl)methyl 2-[methyl-(4-methylphenyl)sulfonylamino]acetate?
The molecular weight of (2-Cyanophenyl)methyl 2-[methyl-(4-methylphenyl)sulfonylamino]acetate is 358.10 g/mol.
Where can I buy (2-Cyanophenyl)methyl 2-[methyl-(4-methylphenyl)sulfonylamino]acetate?
You can request a quote for (2-Cyanophenyl)methyl 2-[methyl-(4-methylphenyl)sulfonylamino]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-Cyanophenyl)methyl 2-[methyl-(4-methylphenyl)sulfonylamino]acetate?
Yes, KEHONG BIO provides custom synthesis services for (2-Cyanophenyl)methyl 2-[methyl-(4-methylphenyl)sulfonylamino]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.