3-(Glutathion-S-yl)-1,4-naphthoquinone
TL;DR: 3-(Glutathion-S-yl)-1,4-naphthoquinone (CAS 114576-98-6) is a chemical compound with molecular formula C20H23N3O8S and molecular weight 465.12057 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4S)-4-amino-5-[[(2R)-1-(carboxymethylamino)-3-(1,4-dihydroxynaphthalen-2-yl)sulfanyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid
Also Known As: GSYNQ, 3-(Glutathion-S-yl)-1,4-naphthoquinone, SID:134223546, (4S)-4-amino-5-[[(2R)-1-(carboxymethylamino)-3-(1,4-dihydroxynaphthalen-2-yl)sulfanyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid, Glycine, N-(S-(1,4-dihydroxy-2-naphthalenyl)-N-L-gamma-glutamyl-L-cysteinyl)-
Technical Specifications
| Molecular Formula | C20H23N3O8S |
| Molecular Weight | 465.12057 g/mol |
| XLogP | -2.0 |
| Topological Polar Surface Area (TPSA) | 225.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 11 |
| Exact Mass | 465.12057 Da |
| Heavy Atoms | 32 |
| Complexity | 694.0 |
| SMILES | C1=CC=C2C(=C1)C(=CC(=C2O)SC[C@@H](C(=O)NCC(=O)O)NC(=O)[C@H](CCC(=O)O)N)O |
| InChIKey | YKXMZVCXFUUVNI-STQMWFEESA-N |
Chemical Property Profile of 3-(Glutathion-S-yl)-1,4-naphthoquinone
Property Insights of 3-(Glutathion-S-yl)-1,4-naphthoquinone
The XLogP value of -2.0 indicates that 3-(Glutathion-S-yl)-1,4-naphthoquinone is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 225.0 Ų indicates high polarity, suggesting 3-(Glutathion-S-yl)-1,4-naphthoquinone may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3-(Glutathion-S-yl)-1,4-naphthoquinone has 7 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 3-(Glutathion-S-yl)-1,4-naphthoquinone?
The CAS number of 3-(Glutathion-S-yl)-1,4-naphthoquinone is 114576-98-6.
What is the molecular formula of 3-(Glutathion-S-yl)-1,4-naphthoquinone?
The molecular formula of 3-(Glutathion-S-yl)-1,4-naphthoquinone is C20H23N3O8S.
What is the molecular weight of 3-(Glutathion-S-yl)-1,4-naphthoquinone?
The molecular weight of 3-(Glutathion-S-yl)-1,4-naphthoquinone is 465.12057 g/mol.
Where can I buy 3-(Glutathion-S-yl)-1,4-naphthoquinone?
You can request a quote for 3-(Glutathion-S-yl)-1,4-naphthoquinone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(Glutathion-S-yl)-1,4-naphthoquinone?
Yes, CoreyChem provides custom synthesis services for 3-(Glutathion-S-yl)-1,4-naphthoquinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.