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Methyl N-(4-methylphenyl)-N-[(4-methylphenyl)sulfonyl]glycinate
TL;DR: Methyl N-(4-methylphenyl)-N-[(4-methylphenyl)sulfonyl]glycinate (CAS 418804-41-8) is a chemical compound with molecular formula C17H19NO4S and molecular weight 333.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(4-methyl-N-(4-methylphenyl)sulfonylanilino)acetate
Also Known As: Methyl N-(4-methylphenyl)-N-[(4-methylphenyl)sulfonyl]glycinate, methyl 2-(4-methyl-N-(4-methylphenyl)sulfonylanilino)acetate, METHYL 2-[N-(4-METHYLPHENYL)4-METHYLBENZENESULFONAMIDO]ACETATE, glycine, N-(4-methylphenyl)-N-[(4-methylphenyl)sulfonyl]-, methyl ester, Methyl N-(4-methylphenyl)-N-(4-methylphenyl)sulfonylglycinate
| Molecular Formula | C17H19NO4S |
|---|---|
| Molecular Weight | 333.10 g/mol |
| LogP | 2.67174 |
| Topological Polar Surface Area | 63.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 333.1035 |
| Heavy Atoms | 23 |
| Complexity | 780.348 |
Chemical Identifiers
| CAS Number | 418804-41-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N(CC(=O)OC)S(=O)(=O)C2=CC=C(C=C2)C |
Product Overview
Methyl N-(4-methylphenyl)-N-[(4-methylphenyl)sulfonyl]glycinate (CAS 418804-41-8), with molecular formula C17H19NO4S and molecular weight 333.10 g/mol. IUPAC: methyl 2-(4-methyl-N-(4-methylphenyl)sulfonylanilino)acetate.
Chemical Property Profile of Methyl N-(4-methylphenyl)-N-[(4-methylphenyl)sulfonyl]glycinate
Property Insights of Methyl N-(4-methylphenyl)-N-[(4-methylphenyl)sulfonyl]glycinate
The XLogP value of 2.67174 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl N-(4-methylphenyl)-N-[(4-methylphenyl)sulfonyl]glycinate. The TPSA of 63.68 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl N-(4-methylphenyl)-N-[(4-methylphenyl)sulfonyl]glycinate. Following Lipinski's Rule of Five, Methyl N-(4-methylphenyl)-N-[(4-methylphenyl)sulfonyl]glycinate has 0 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 N-(4-methylphenyl)-N-[(4-methylphenyl)sulfonyl]glycinate?
The CAS number of Methyl N-(4-methylphenyl)-N-[(4-methylphenyl)sulfonyl]glycinate is 418804-41-8.
What is the molecular formula of Methyl N-(4-methylphenyl)-N-[(4-methylphenyl)sulfonyl]glycinate?
The molecular formula of Methyl N-(4-methylphenyl)-N-[(4-methylphenyl)sulfonyl]glycinate is C17H19NO4S.
What is the molecular weight of Methyl N-(4-methylphenyl)-N-[(4-methylphenyl)sulfonyl]glycinate?
The molecular weight of Methyl N-(4-methylphenyl)-N-[(4-methylphenyl)sulfonyl]glycinate is 333.10 g/mol.
Where can I buy Methyl N-(4-methylphenyl)-N-[(4-methylphenyl)sulfonyl]glycinate?
You can request a quote for Methyl N-(4-methylphenyl)-N-[(4-methylphenyl)sulfonyl]glycinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl N-(4-methylphenyl)-N-[(4-methylphenyl)sulfonyl]glycinate?
Yes, KEHONG BIO provides custom synthesis services for Methyl N-(4-methylphenyl)-N-[(4-methylphenyl)sulfonyl]glycinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.