2-Bromo-6-(glutathion-S-yl)hydroquinone
TL;DR: 2-Bromo-6-(glutathion-S-yl)hydroquinone (CAS 114865-64-4) is a chemical compound with molecular formula C16H20BrN3O8S and molecular weight 493.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-amino-5-[[(2R)-3-(3-bromo-2,5-dihydroxyphenyl)sulfanyl-1-(carboxymethylamino)-1-oxopropan-2-yl]amino]-5-oxopentanoic acid
Also Known As: 2-Br-6-(Gsyl)HQ, 2-Bromo-6-(glutathion-S-yl)hydroquinone, 2-bromo-6-glutathion-S-yl-hydroquinone, 2-Bromo-6-(monoglutathion-S-yl)hydroquinone, (2S)-2-amino-5-[[(2R)-3-(3-bromo-2,5-dihydroxyphenyl)sulfanyl-1-(carboxymethylamino)-1-oxopropan-2-yl]amino]-5-oxopentanoic acid
| Molecular Formula | C16H20BrN3O8S |
|---|---|
| Molecular Weight | 493.02 g/mol |
| LogP | -2.6 |
| Topological Polar Surface Area | 225.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 11 |
| Exact Mass | 493.01544 |
| Heavy Atoms | 29 |
| Complexity | 611.0 |
Chemical Identifiers
| CAS Number | 114865-64-4 |
|---|---|
| SMILES | C1=C(C=C(C(=C1SC[C@@H](C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N)O)Br)O |
| InChIKey | QSJZDQPQNVINPC-UWVGGRQHSA-N |
Product Overview
2-Bromo-6-(glutathion-S-yl)hydroquinone (CAS 114865-64-4), with molecular formula C16H20BrN3O8S and molecular weight 493.02 g/mol. IUPAC: (2S)-2-amino-5-[[(2R)-3-(3-bromo-2,5-dihydroxyphenyl)sulfanyl-1-(carboxymethylamino)-1-oxopropan-2-yl]amino]-5-oxopentanoic acid.
Chemical Property Profile of 2-Bromo-6-(glutathion-S-yl)hydroquinone
Property Insights of 2-Bromo-6-(glutathion-S-yl)hydroquinone
The XLogP value of -2.6 indicates that 2-Bromo-6-(glutathion-S-yl)hydroquinone is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 225.0 Ų indicates high polarity, suggesting 2-Bromo-6-(glutathion-S-yl)hydroquinone may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-Bromo-6-(glutathion-S-yl)hydroquinone has 7 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Bromo-6-(glutathion-S-yl)hydroquinone?
The CAS number of 2-Bromo-6-(glutathion-S-yl)hydroquinone is 114865-64-4.
What is the molecular formula of 2-Bromo-6-(glutathion-S-yl)hydroquinone?
The molecular formula of 2-Bromo-6-(glutathion-S-yl)hydroquinone is C16H20BrN3O8S.
What is the molecular weight of 2-Bromo-6-(glutathion-S-yl)hydroquinone?
The molecular weight of 2-Bromo-6-(glutathion-S-yl)hydroquinone is 493.02 g/mol.
Where can I buy 2-Bromo-6-(glutathion-S-yl)hydroquinone?
You can request a quote for 2-Bromo-6-(glutathion-S-yl)hydroquinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Bromo-6-(glutathion-S-yl)hydroquinone?
Yes, KEHONG BIO provides custom synthesis services for 2-Bromo-6-(glutathion-S-yl)hydroquinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.