S-(Tetrachloromethylthiophenyl)glutathione
TL;DR: S-(Tetrachloromethylthiophenyl)glutathione (CAS 87390-29-2) is a chemical compound with molecular formula C17H19Cl4N3O6S2 and molecular weight 564.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-5-[[1-(carboxymethylamino)-1-oxo-3-(2,3,4,5-tetrachloro-6-methylsulfanylphenyl)sulfanylpropan-2-yl]amino]-5-oxopentanoic acid
Also Known As: S-(Tetrachloromethylthiophenyl)glutathione, Glycine, N-(N-L-gamma-glutamyl-S-(tetrachloro(methylthio)phenyl)-L-cysteinyl)-, 2-amino-4-[[1-(carboxymethylcarbamoyl)-2-(2,3,4,5-tetrachloro-6-methylsulfanyl-phenyl)sulfanyl-ethyl]carbamoyl]butanoic acid, 2-amino-5-[[1-(carboxymethylamino)-1-oxo-3-(2,3,4,5-tetrachloro-6-methylsulfanylphenyl)sulfanylpropan-2-yl]amino]-5-oxopentanoic acid, 5-[(1-[(Carboxymethyl)imino]-1-hydroxy-3-{[2,3,4,5-tetrachloro-6-(methylsulfanyl)phenyl]sulfanyl}propan-2-yl)imino]-5-hydroxynorvaline
| Molecular Formula | C17H19Cl4N3O6S2 |
|---|---|
| Molecular Weight | 564.95 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 209.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 12 |
| Exact Mass | 564.94696 |
| Heavy Atoms | 32 |
| Complexity | 695.0 |
Chemical Identifiers
| CAS Number | 87390-29-2 |
|---|---|
| SMILES | CSC1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)SCC(C(=O)NCC(=O)O)NC(=O)CCC(C(=O)O)N |
| InChIKey | YTNWSHRKOASQFM-UHFFFAOYSA-N |
Product Overview
S-(Tetrachloromethylthiophenyl)glutathione (CAS 87390-29-2), with molecular formula C17H19Cl4N3O6S2 and molecular weight 564.95 g/mol. IUPAC: 2-amino-5-[[1-(carboxymethylamino)-1-oxo-3-(2,3,4,5-tetrachloro-6-methylsulfanylphenyl)sulfanylpropan-2-yl]amino]-5-oxopentanoic acid.
Chemical Property Profile of S-(Tetrachloromethylthiophenyl)glutathione
Property Insights of S-(Tetrachloromethylthiophenyl)glutathione
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for S-(Tetrachloromethylthiophenyl)glutathione. The TPSA of 209.0 Ų indicates high polarity, suggesting S-(Tetrachloromethylthiophenyl)glutathione may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, S-(Tetrachloromethylthiophenyl)glutathione has 5 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of S-(Tetrachloromethylthiophenyl)glutathione?
The CAS number of S-(Tetrachloromethylthiophenyl)glutathione is 87390-29-2.
What is the molecular formula of S-(Tetrachloromethylthiophenyl)glutathione?
The molecular formula of S-(Tetrachloromethylthiophenyl)glutathione is C17H19Cl4N3O6S2.
What is the molecular weight of S-(Tetrachloromethylthiophenyl)glutathione?
The molecular weight of S-(Tetrachloromethylthiophenyl)glutathione is 564.95 g/mol.
Where can I buy S-(Tetrachloromethylthiophenyl)glutathione?
You can request a quote for S-(Tetrachloromethylthiophenyl)glutathione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-(Tetrachloromethylthiophenyl)glutathione?
Yes, KEHONG BIO provides custom synthesis services for S-(Tetrachloromethylthiophenyl)glutathione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.