2,3-(di-glutathion-S-yl)-1,4-naphthoquinone
TL;DR: 2,3-(di-glutathion-S-yl)-1,4-naphthoquinone (CAS 107435-57-4) is a chemical compound with molecular formula C30H36N6O14S2 and molecular weight 768.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-amino-5-[[(2S)-2-[3-[(2S)-2-[[(4S)-4-amino-4-carboxybutanoyl]amino]-1-(carboxymethylamino)-1-oxo-3-sulfanylpropan-2-yl]-1,4-dioxonaphthalen-2-yl]-1-(carboxymethylamino)-1-oxo-3-sulfanylpropan-2-yl]amino]-5-oxopentanoic acid
Also Known As: Dgsynq, 2,3-(Di-glutathion-S-yl)-1,4-naphthoquinone, SID:134221977, 3-aminopropyl-(2-hydroxyethyl)-dimethylazanium,chloride, (2S)-2-amino-5-[[(2S)-2-[3-[(2S)-2-[[(4S)-4-amino-4-carboxybutanoyl]amino]-1-(carboxymethylamino)-1-oxo-3-sulfanylpropan-2-yl]-1,4-dioxonaphthalen-2-yl]-1-(carboxymethylamino)-1-oxo-3-sulfanylpropan-2-yl]amino]-5-oxopentanoic acid
| Molecular Formula | C30H36N6O14S2 |
|---|---|
| Molecular Weight | 768.17 g/mol |
| LogP | -7.3 |
| Topological Polar Surface Area | 354.0 Ų |
| Hydrogen Bond Donors | 12 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 20 |
| Exact Mass | 768.1731 |
| Heavy Atoms | 52 |
| Complexity | 1430.0 |
Chemical Identifiers
| CAS Number | 107435-57-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C(=C(C2=O)[C@@](CS)(C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N)[C@@](CS)(C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N |
| InChIKey | PYPHCUPQHPLOPW-RMYXUZSKSA-N |
Product Overview
2,3-(di-glutathion-S-yl)-1,4-naphthoquinone (CAS 107435-57-4), with molecular formula C30H36N6O14S2 and molecular weight 768.17 g/mol. IUPAC: (2S)-2-amino-5-[[(2S)-2-[3-[(2S)-2-[[(4S)-4-amino-4-carboxybutanoyl]amino]-1-(carboxymethylamino)-1-oxo-3-sulfanylpropan-2-yl]-1,4-dioxonaphthalen-2-yl]-1-(carboxymethylamino)-1-oxo-3-sulfanylpropan-2-yl]amino]-5-oxopentanoic acid.
Chemical Property Profile of 2,3-(di-glutathion-S-yl)-1,4-naphthoquinone
Property Insights of 2,3-(di-glutathion-S-yl)-1,4-naphthoquinone
The XLogP value of -7.3 indicates that 2,3-(di-glutathion-S-yl)-1,4-naphthoquinone is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 354.0 Ų indicates high polarity, suggesting 2,3-(di-glutathion-S-yl)-1,4-naphthoquinone may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2,3-(di-glutathion-S-yl)-1,4-naphthoquinone has 12 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,3-(di-glutathion-S-yl)-1,4-naphthoquinone?
The CAS number of 2,3-(di-glutathion-S-yl)-1,4-naphthoquinone is 107435-57-4.
What is the molecular formula of 2,3-(di-glutathion-S-yl)-1,4-naphthoquinone?
The molecular formula of 2,3-(di-glutathion-S-yl)-1,4-naphthoquinone is C30H36N6O14S2.
What is the molecular weight of 2,3-(di-glutathion-S-yl)-1,4-naphthoquinone?
The molecular weight of 2,3-(di-glutathion-S-yl)-1,4-naphthoquinone is 768.17 g/mol.
Where can I buy 2,3-(di-glutathion-S-yl)-1,4-naphthoquinone?
You can request a quote for 2,3-(di-glutathion-S-yl)-1,4-naphthoquinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-(di-glutathion-S-yl)-1,4-naphthoquinone?
Yes, KEHONG BIO provides custom synthesis services for 2,3-(di-glutathion-S-yl)-1,4-naphthoquinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.