S-Benzylglutathione
TL;DR: S-Benzylglutathione (CAS 78971-86-5) is a chemical compound with molecular formula C17H23N3O6S and molecular weight 397.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-amino-5-[[(2R)-2-amino-3-benzylsulfanylpropanoyl]-(carboxymethyl)amino]-5-oxopentanoic acid
Also Known As: S-Benzylglutathione, s-benzyl-glutathione, s-benzyl-l-cysteinyl-n-l-, A-glutamylglycine, Glycine, N-(N-L-gamma-glutamyl-S-(phenylmethyl)-L-cysteinyl)-
| Molecular Formula | C17H23N3O6S |
|---|---|
| Molecular Weight | 397.13 g/mol |
| LogP | -5.2 |
| Topological Polar Surface Area | 189.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 11 |
| Exact Mass | 397.13077 |
| Heavy Atoms | 27 |
| Complexity | 539.0 |
Chemical Identifiers
| CAS Number | 78971-86-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)CSC[C@@H](C(=O)N(CC(=O)O)C(=O)CC[C@@H](C(=O)O)N)N |
| InChIKey | YQCILXFRGOTSAB-STQMWFEESA-N |
Product Overview
S-Benzylglutathione (CAS 78971-86-5), with molecular formula C17H23N3O6S and molecular weight 397.13 g/mol. IUPAC: (2S)-2-amino-5-[[(2R)-2-amino-3-benzylsulfanylpropanoyl]-(carboxymethyl)amino]-5-oxopentanoic acid.
Chemical Property Profile of S-Benzylglutathione
Property Insights of S-Benzylglutathione
The XLogP value of -5.2 indicates that S-Benzylglutathione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 189.0 Ų indicates high polarity, suggesting S-Benzylglutathione may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, S-Benzylglutathione has 4 hydrogen bond donor(s) and 9 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 S-Benzylglutathione?
The CAS number of S-Benzylglutathione is 78971-86-5.
What is the molecular formula of S-Benzylglutathione?
The molecular formula of S-Benzylglutathione is C17H23N3O6S.
What is the molecular weight of S-Benzylglutathione?
The molecular weight of S-Benzylglutathione is 397.13 g/mol.
Where can I buy S-Benzylglutathione?
You can request a quote for S-Benzylglutathione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-Benzylglutathione?
Yes, KEHONG BIO provides custom synthesis services for S-Benzylglutathione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.