N-Trifluoroacetyl-L-cysteine methyl ester
TL;DR: N-Trifluoroacetyl-L-cysteine methyl ester (CAS 1577-62-4) is a chemical compound with molecular formula C6H8F3NO3S and molecular weight 231.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2R)-3-sulfanyl-2-[(2,2,2-trifluoroacetyl)amino]propanoate
Also Known As: N-Trifluoroacetyl-L-cysteine methyl ester, N-TFA-Cys-OCH3, N-Trifluoroacetyl-l-cysteinemethyl ester, (R)-Methyl 3-mercapto-2-(2,2,2-trifluoroacetamido)propanoate, methyl (2R)-3-sulfanyl-2-[(2,2,2-trifluoroacetyl)amino]propanoate
| Molecular Formula | C6H8F3NO3S |
|---|---|
| Molecular Weight | 231.02 g/mol |
| LogP | 0.1363 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 231.0177 |
| Heavy Atoms | 14 |
| Complexity | 230.85184 |
Chemical Identifiers
| CAS Number | 1577-62-4 |
|---|---|
| SMILES | COC(=O)[C@H](CS)NC(=O)C(F)(F)F |
Product Overview
N-Trifluoroacetyl-L-cysteine methyl ester (CAS 1577-62-4), with molecular formula C6H8F3NO3S and molecular weight 231.02 g/mol. IUPAC: methyl (2R)-3-sulfanyl-2-[(2,2,2-trifluoroacetyl)amino]propanoate.
Chemical Property Profile of N-Trifluoroacetyl-L-cysteine methyl ester
Property Insights of N-Trifluoroacetyl-L-cysteine methyl ester
The XLogP value of 0.1363 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Trifluoroacetyl-L-cysteine methyl ester. With a topological polar surface area (TPSA) of 55.4 Ų, N-Trifluoroacetyl-L-cysteine methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Trifluoroacetyl-L-cysteine methyl ester has 2 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 N-Trifluoroacetyl-L-cysteine methyl ester?
The CAS number of N-Trifluoroacetyl-L-cysteine methyl ester is 1577-62-4.
What is the molecular formula of N-Trifluoroacetyl-L-cysteine methyl ester?
The molecular formula of N-Trifluoroacetyl-L-cysteine methyl ester is C6H8F3NO3S.
What is the molecular weight of N-Trifluoroacetyl-L-cysteine methyl ester?
The molecular weight of N-Trifluoroacetyl-L-cysteine methyl ester is 231.02 g/mol.
Where can I buy N-Trifluoroacetyl-L-cysteine methyl ester?
You can request a quote for N-Trifluoroacetyl-L-cysteine methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Trifluoroacetyl-L-cysteine methyl ester?
Yes, KEHONG BIO provides custom synthesis services for N-Trifluoroacetyl-L-cysteine methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.