Methyl 2-(4-methylphenylsulfonamido)-2-phenylacetate
TL;DR: Methyl 2-(4-methylphenylsulfonamido)-2-phenylacetate (CAS 111047-54-2) is a chemical compound with molecular formula C16H17NO4S and molecular weight 319.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(4-methylphenyl)sulfonylamino]-2-phenylacetate
Also Known As: Methyl 2-(4-methylphenylsulfonamido)-2-phenylacetate, methyl 2-{[(4-methylphenyl)sulfonyl]amino}-2-phenylacetate, 4466AA, N-Tosyl-2-phenylglycine methyl ester, methylmethylphenylsulfonylaminophenylacetate
| Molecular Formula | C16H17NO4S |
|---|---|
| Molecular Weight | 319.09 g/mol |
| LogP | 2.18762 |
| Topological Polar Surface Area | 72.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 319.08783 |
| Heavy Atoms | 22 |
| Complexity | 739.4751 |
Chemical Identifiers
| CAS Number | 111047-54-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NC(C2=CC=CC=C2)C(=O)OC |
Product Overview
Methyl 2-(4-methylphenylsulfonamido)-2-phenylacetate (CAS 111047-54-2), with molecular formula C16H17NO4S and molecular weight 319.09 g/mol. IUPAC: methyl 2-[(4-methylphenyl)sulfonylamino]-2-phenylacetate.
Chemical Property Profile of Methyl 2-(4-methylphenylsulfonamido)-2-phenylacetate
Property Insights of Methyl 2-(4-methylphenylsulfonamido)-2-phenylacetate
The XLogP value of 2.18762 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-(4-methylphenylsulfonamido)-2-phenylacetate. The TPSA of 72.47 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-(4-methylphenylsulfonamido)-2-phenylacetate. Following Lipinski's Rule of Five, Methyl 2-(4-methylphenylsulfonamido)-2-phenylacetate has 1 hydrogen bond donor(s) and 4 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 Methyl 2-(4-methylphenylsulfonamido)-2-phenylacetate?
The CAS number of Methyl 2-(4-methylphenylsulfonamido)-2-phenylacetate is 111047-54-2.
What is the molecular formula of Methyl 2-(4-methylphenylsulfonamido)-2-phenylacetate?
The molecular formula of Methyl 2-(4-methylphenylsulfonamido)-2-phenylacetate is C16H17NO4S.
What is the molecular weight of Methyl 2-(4-methylphenylsulfonamido)-2-phenylacetate?
The molecular weight of Methyl 2-(4-methylphenylsulfonamido)-2-phenylacetate is 319.09 g/mol.
Where can I buy Methyl 2-(4-methylphenylsulfonamido)-2-phenylacetate?
You can request a quote for Methyl 2-(4-methylphenylsulfonamido)-2-phenylacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-(4-methylphenylsulfonamido)-2-phenylacetate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-(4-methylphenylsulfonamido)-2-phenylacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.