Poly-S-benzylcysteine
TL;DR: Poly-S-benzylcysteine (CAS 25980-26-1) is a chemical compound with molecular formula C52H38Cl2N8O3S and molecular weight 924.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2Z)-6-chloro-2-[(E)-3-(6-chloro-1,3-diphenyl-2H-imidazo[4,5-b]quinoxalin-9-ium-2-yl)prop-2-enylidene]-1,3-diphenylimidazo[4,5-b]quinoxaline;4-methylbenzenesulfonate
Also Known As: Poly-S-benzylcysteine, 1H-Imidazo(4,5-b)quinoxalinium, 6-chloro-2-(3-(6-chloro-1,3-diphenyl-2H-imidazo(4,5-b)quinoxalin-2-ylidene)-1-propeny l)-1,3-diphenyl-, salt with 4-methylbenzenesulfonic acid (1:1), 6-Chloro-2-(3-(6-chloro-1,3-diphenyl-2H-imidazo(4,5-b)quinoxalin-2-ylidene)-1-propeny l)-1,3-diphenyl-1H-imidazo(4,5-b)quinoxalinium salt with 4-methylbenzenesulfonic acid (1:1), (2Z)-6-chloro-2-[(E)-3-(6-chloro-1,3-diphenyl-2H-imidazo[4,5-b]quinoxalin-9-ium-2-yl)prop-2-enylidene]-1,3-diphenylimidazo[4,5-b]quinoxaline; 4-methylbenzenesulfonate
| Molecular Formula | C52H38Cl2N8O3S |
|---|---|
| Molecular Weight | 924.22 g/mol |
| LogP | 12.20152 |
| Topological Polar Surface Area | 122.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 924.2165 |
| Heavy Atoms | 66 |
| Complexity | 3405.717 |
Chemical Identifiers
| CAS Number | 25980-26-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)[O-].C1=CC=C(C=C1)N2C(N(C3=NC4=C(C=CC(=C4)Cl)[NH+]=C32)C5=CC=CC=C5)/C=C/C=C\6/N(C7=NC8=C(C=C(C=C8)Cl)N=C7N6C9=CC=CC=C9)C1=CC=CC=C1 |
Product Overview
Poly-S-benzylcysteine (CAS 25980-26-1), with molecular formula C52H38Cl2N8O3S and molecular weight 924.22 g/mol. IUPAC: (2Z)-6-chloro-2-[(E)-3-(6-chloro-1,3-diphenyl-2H-imidazo[4,5-b]quinoxalin-9-ium-2-yl)prop-2-enylidene]-1,3-diphenylimidazo[4,5-b]quinoxaline;4-methylbenzenesulfonate.
Chemical Property Profile of Poly-S-benzylcysteine
Property Insights of Poly-S-benzylcysteine
The XLogP value of 12.20152 indicates that Poly-S-benzylcysteine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 122.97 Ų falls within the moderate polarity range, balancing permeability and solubility for Poly-S-benzylcysteine. Following Lipinski's Rule of Five, Poly-S-benzylcysteine has 0 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 Poly-S-benzylcysteine?
The CAS number of Poly-S-benzylcysteine is 25980-26-1.
What is the molecular formula of Poly-S-benzylcysteine?
The molecular formula of Poly-S-benzylcysteine is C52H38Cl2N8O3S.
What is the molecular weight of Poly-S-benzylcysteine?
The molecular weight of Poly-S-benzylcysteine is 924.22 g/mol.
Where can I buy Poly-S-benzylcysteine?
You can request a quote for Poly-S-benzylcysteine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Poly-S-benzylcysteine?
Yes, KEHONG BIO provides custom synthesis services for Poly-S-benzylcysteine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.