![Methyl N-[4-chloro-3-(trifluoromethyl)phenyl]-N-(methylsulfonyl)glycinate structure](/static/products/3334/333446-72-3.webp)
Methyl N-[4-chloro-3-(trifluoromethyl)phenyl]-N-(methylsulfonyl)glycinate
TL;DR: Methyl N-[4-chloro-3-(trifluoromethyl)phenyl]-N-(methylsulfonyl)glycinate (CAS 333446-72-3) is a chemical compound with molecular formula C11H11ClF3NO4S and molecular weight 345.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[4-chloro-N-methylsulfonyl-3-(trifluoromethyl)anilino]acetate
Also Known As: Methyl N-[4-chloro-3-(trifluoromethyl)phenyl]-N-(methylsulfonyl)glycinate, methyl 2-[4-chloro-N-methylsulfonyl-3-(trifluoromethyl)anilino]acetate, glycine, N-[4-chloro-3-(trifluoromethyl)phenyl]-N-(methylsulfonyl)-, methyl ester, METHYL 2-{N-[4-CHLORO-3-(TRIFLUOROMETHYL)PHENYL]METHANESULFONAMIDO}ACETATE, Methyl N-4-chloro-3-(trifluoromethyl)phenyl-N-(methylsulfonyl)glycinate
| Molecular Formula | C11H11ClF3NO4S |
|---|---|
| Molecular Weight | 345.00 g/mol |
| LogP | 2.2978 |
| Topological Polar Surface Area | 63.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 345.00494 |
| Heavy Atoms | 21 |
| Complexity | 645.3587 |
Chemical Identifiers
| CAS Number | 333446-72-3 |
|---|---|
| SMILES | COC(=O)CN(C1=CC(=C(C=C1)Cl)C(F)(F)F)S(=O)(=O)C |
Product Overview
Methyl N-[4-chloro-3-(trifluoromethyl)phenyl]-N-(methylsulfonyl)glycinate (CAS 333446-72-3), with molecular formula C11H11ClF3NO4S and molecular weight 345.00 g/mol. IUPAC: methyl 2-[4-chloro-N-methylsulfonyl-3-(trifluoromethyl)anilino]acetate.
Chemical Property Profile of Methyl N-[4-chloro-3-(trifluoromethyl)phenyl]-N-(methylsulfonyl)glycinate
Property Insights of Methyl N-[4-chloro-3-(trifluoromethyl)phenyl]-N-(methylsulfonyl)glycinate
The XLogP value of 2.2978 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl N-[4-chloro-3-(trifluoromethyl)phenyl]-N-(methylsulfonyl)glycinate. The TPSA of 63.68 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl N-[4-chloro-3-(trifluoromethyl)phenyl]-N-(methylsulfonyl)glycinate. Following Lipinski's Rule of Five, Methyl N-[4-chloro-3-(trifluoromethyl)phenyl]-N-(methylsulfonyl)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-chloro-3-(trifluoromethyl)phenyl]-N-(methylsulfonyl)glycinate?
The CAS number of Methyl N-[4-chloro-3-(trifluoromethyl)phenyl]-N-(methylsulfonyl)glycinate is 333446-72-3.
What is the molecular formula of Methyl N-[4-chloro-3-(trifluoromethyl)phenyl]-N-(methylsulfonyl)glycinate?
The molecular formula of Methyl N-[4-chloro-3-(trifluoromethyl)phenyl]-N-(methylsulfonyl)glycinate is C11H11ClF3NO4S.
What is the molecular weight of Methyl N-[4-chloro-3-(trifluoromethyl)phenyl]-N-(methylsulfonyl)glycinate?
The molecular weight of Methyl N-[4-chloro-3-(trifluoromethyl)phenyl]-N-(methylsulfonyl)glycinate is 345.00 g/mol.
Where can I buy Methyl N-[4-chloro-3-(trifluoromethyl)phenyl]-N-(methylsulfonyl)glycinate?
You can request a quote for Methyl N-[4-chloro-3-(trifluoromethyl)phenyl]-N-(methylsulfonyl)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-chloro-3-(trifluoromethyl)phenyl]-N-(methylsulfonyl)glycinate?
Yes, KEHONG BIO provides custom synthesis services for Methyl N-[4-chloro-3-(trifluoromethyl)phenyl]-N-(methylsulfonyl)glycinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.