Coralyne sulfoacetate
TL;DR: Coralyne sulfoacetate (CAS 38989-37-6) is a chemical compound with molecular formula C24H25NO9S and molecular weight 503.125 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-hydroxy-2-oxoethanesulfonate;2,3,10,11-tetramethoxy-8-methylisoquinolino[2,1-b]isoquinolin-7-ium
Also Known As: Coralyne sulfoacetate, Monoanhydride with sulfuric acid, Dibenzo(a,g)quinolizinium, 2,3,10,11-tetramethoxy-8-methyl-, saltwith sulfoacetic acid (1:1), Dibenzo(a,g)quinolizinium, 2,3,10,11-tetramethoxy-8-methyl-, salt with sulfoacetic acid (1:1), Dibenzo(a,g)quinolizinium, 2,3,10,11-tetramethoxy-8-methyl-, 2-sulfoacetate (1:1)
Technical Specifications
| Molecular Formula | C24H25NO9S |
| Molecular Weight | 503.125 g/mol |
| XLogP | 2.69 |
| Topological Polar Surface Area (TPSA) | 144.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 503.125 Da |
| Heavy Atoms | 35 |
| Complexity | 660.0 |
| SMILES | CC1=C2C=C(C(=CC2=CC3=[N+]1C=CC4=CC(=C(C=C43)OC)OC)OC)OC.C(C(=O)O)S(=O)(=O)[O-] |
| InChIKey | KRPNDEFBHRAWPW-UHFFFAOYSA-M |
Chemical Property Profile of Coralyne sulfoacetate
Property Insights of Coralyne sulfoacetate
The XLogP value of 2.69 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Coralyne sulfoacetate. The TPSA of 144.0 Ų indicates high polarity, suggesting Coralyne sulfoacetate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Coralyne sulfoacetate has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Coralyne sulfoacetate?
The CAS number of Coralyne sulfoacetate is 38989-37-6.
What is the molecular formula of Coralyne sulfoacetate?
The molecular formula of Coralyne sulfoacetate is C24H25NO9S.
What is the molecular weight of Coralyne sulfoacetate?
The molecular weight of Coralyne sulfoacetate is 503.125 g/mol.
Where can I buy Coralyne sulfoacetate?
You can request a quote for Coralyne sulfoacetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Coralyne sulfoacetate?
Yes, CoreyChem provides custom synthesis services for Coralyne sulfoacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.