S-(4-nitrobenzyl)-glutathione
TL;DR: S-(4-nitrobenzyl)-glutathione (CAS 6803-19-6) is a chemical compound with molecular formula C17H22N4O8S and molecular weight 442.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-5-[[1-(carboxymethylamino)-3-[(4-nitrophenyl)methylsulfanyl]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid
Also Known As: S-(4-Nitrobenzyl)glutathione, s-(p-nitrobenzyl)glutathione, S-(4-nitrobenzyl)-glutathione, A-glutamyl-s-(4-nitrobenzyl)cysteinylglycine, 2-amino-5-[[1-(carboxymethylamino)-3-[(4-nitrophenyl)methylsulfanyl]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid
| Molecular Formula | C17H22N4O8S |
|---|---|
| Molecular Weight | 442.12 g/mol |
| LogP | -2.8 |
| Topological Polar Surface Area | 230.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 12 |
| Exact Mass | 442.11584 |
| Heavy Atoms | 30 |
| Complexity | 634.0 |
Chemical Identifiers
| CAS Number | 6803-19-6 |
|---|---|
| SMILES | C1=CC(=CC=C1CSCC(C(=O)NCC(=O)O)NC(=O)CCC(C(=O)O)N)[N+](=O)[O-] |
| InChIKey | OAWORKDPTSAMBZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
S-(4-nitrobenzyl)-glutathione (CAS 6803-19-6), with molecular formula C17H22N4O8S and molecular weight 442.12 g/mol. IUPAC: 2-amino-5-[[1-(carboxymethylamino)-3-[(4-nitrophenyl)methylsulfanyl]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid.
Chemical Property Profile of S-(4-nitrobenzyl)-glutathione
Property Insights of S-(4-nitrobenzyl)-glutathione
The XLogP value of -2.8 indicates that S-(4-nitrobenzyl)-glutathione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 230.0 Ų indicates high polarity, suggesting S-(4-nitrobenzyl)-glutathione may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, S-(4-nitrobenzyl)-glutathione has 5 hydrogen bond donor(s) and 10 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-(4-nitrobenzyl)-glutathione?
The CAS number of S-(4-nitrobenzyl)-glutathione is 6803-19-6.
What is the molecular formula of S-(4-nitrobenzyl)-glutathione?
The molecular formula of S-(4-nitrobenzyl)-glutathione is C17H22N4O8S.
What is the molecular weight of S-(4-nitrobenzyl)-glutathione?
The molecular weight of S-(4-nitrobenzyl)-glutathione is 442.12 g/mol.
Where can I buy S-(4-nitrobenzyl)-glutathione?
You can request a quote for S-(4-nitrobenzyl)-glutathione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-(4-nitrobenzyl)-glutathione?
Yes, KEHONG BIO provides custom synthesis services for S-(4-nitrobenzyl)-glutathione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.