1,4-(bis-glutathion-S-yl)-1,2,3,4-tetrachloro-1,3-butadiene
TL;DR: 1,4-(bis-glutathion-S-yl)-1,2,3,4-tetrachloro-1,3-butadiene (CAS 117707-49-0) is a chemical compound with molecular formula C24H32Cl4N6O12S2 and molecular weight 800.02734 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-2-amino-5-[[(2S,3E,5E,7S)-7-[[(4S)-4-amino-4-carboxybutanoyl]amino]-1,8-bis(carboxymethylamino)-3,4,5,6-tetrachloro-1,8-dioxo-2,7-bis(sulfanylmethyl)octa-3,5-dien-2-yl]amino]-5-oxopentanoic acid
Also Known As: BCTB, BGTCB, 8-Hydroxy-1-nitrobenzo(e)pyrene, 1,4-(Bis-glutathion-S-yl)-1,2,3,4-tetrachloro-1,3-butadiene, 1,4-Bis(glutathion-S-yl)-1,2,3,4-tetrachlorobuta-1,3-diene
Technical Specifications
| Molecular Formula | C24H32Cl4N6O12S2 |
| Molecular Weight | 800.02734 g/mol |
| XLogP | -6.6 |
| Topological Polar Surface Area (TPSA) | 320.0 Ų |
| Hydrogen Bond Donors | 12 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 21 |
| Exact Mass | 800.02734 Da |
| Heavy Atoms | 48 |
| Complexity | 1270.0 |
| SMILES | C([C@H](N)C(=O)O)CC(=O)N[C@](C(=O)NCC(=O)O)(/C(=C(\Cl)/C(=C(\Cl)/[C@](NC(=O)CC[C@H](N)C(=O)O)(C(=O)NCC(=O)O)CS)/Cl)/Cl)CS |
| InChIKey | CPQIOCSSYOKBQY-FYXRKLMBSA-N |
Product Description
Applications: 1,4-(bis-glutathion-S-yl)-1,2,3,4-tetrachloro-1,3-butadiene is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
1,4-(bis-glutathion-S-yl)-1,2,3,4-tetrachloro-1,3-butadiene is a fine chemical identified by CAS number 117707-49-0 and the molecular formula C24H32Cl4N6O12S2 and a molecular weight of 800.03 g/mol. Synonyms include BCTB and BGTCB.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 1,4-(bis-glutathion-S-yl)-1,2,3,4-tetrachloro-1,3-butadiene
Property Insights of 1,4-(bis-glutathion-S-yl)-1,2,3,4-tetrachloro-1,3-butadiene
The XLogP value of -6.6 indicates that 1,4-(bis-glutathion-S-yl)-1,2,3,4-tetrachloro-1,3-butadiene is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 320.0 Ų indicates high polarity, suggesting 1,4-(bis-glutathion-S-yl)-1,2,3,4-tetrachloro-1,3-butadiene may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,4-(bis-glutathion-S-yl)-1,2,3,4-tetrachloro-1,3-butadiene has 12 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 1,4-(bis-glutathion-S-yl)-1,2,3,4-tetrachloro-1,3-butadiene?
The CAS number of 1,4-(bis-glutathion-S-yl)-1,2,3,4-tetrachloro-1,3-butadiene is 117707-49-0.
What is the molecular formula of 1,4-(bis-glutathion-S-yl)-1,2,3,4-tetrachloro-1,3-butadiene?
The molecular formula of 1,4-(bis-glutathion-S-yl)-1,2,3,4-tetrachloro-1,3-butadiene is C24H32Cl4N6O12S2.
What is the molecular weight of 1,4-(bis-glutathion-S-yl)-1,2,3,4-tetrachloro-1,3-butadiene?
The molecular weight of 1,4-(bis-glutathion-S-yl)-1,2,3,4-tetrachloro-1,3-butadiene is 800.02734 g/mol.
What are the applications of 1,4-(bis-glutathion-S-yl)-1,2,3,4-tetrachloro-1,3-butadiene?
1,4-(bis-glutathion-S-yl)-1,2,3,4-tetrachloro-1,3-butadiene is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full...
Where can I buy 1,4-(bis-glutathion-S-yl)-1,2,3,4-tetrachloro-1,3-butadiene?
You can request a quote for 1,4-(bis-glutathion-S-yl)-1,2,3,4-tetrachloro-1,3-butadiene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,4-(bis-glutathion-S-yl)-1,2,3,4-tetrachloro-1,3-butadiene?
Yes, CoreyChem provides custom synthesis services for 1,4-(bis-glutathion-S-yl)-1,2,3,4-tetrachloro-1,3-butadiene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.