Macrocyclic bisacridine
TL;DR: Macrocyclic bisacridine (CAS 122332-78-9) is a chemical compound with molecular formula C46H56N8O2S2 and molecular weight 816.3968 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7,18-dithia-10,15,26,34,38,43,47,55-octazaheptacyclo[46.8.0.05,56.020,25.024,33.027,32.049,54]hexapentaconta-1(48),2,4,20,22,24(33),25,27,29,31,49,51,53,55-tetradecaene-11,14-dione
Also Known As: Macrocyclic bisacridine, J1.243.808G, 3,14-Dithia-6,11,17,21,26,30-hexaaza-1,16(4,9)-diacridinacyclotriacontaphane-7,10-dione, 7,18-dithia-10,15,26,34,38,43,47,55-octaazaheptacyclo[46.8.0.05,56.020,25.024,33.027,32.049,54]hexapentaconta-1(48),2,4,20,22,24(33),25,27,29,31,49,51,53,55-tetradecaene-11,14-dione, 9,9 -(1,4-Butanediyl)bis[imino(3,1-propanediyl)(imino)][4,4 -(1,4-dioxo-1,4-butanediyl)bis(iminoethylenethiomethylene)bisacridine]
Technical Specifications
| Molecular Formula | C46H56N8O2S2 |
| Molecular Weight | 816.3968 g/mol |
| XLogP | 6.5 |
| Topological Polar Surface Area (TPSA) | 183.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 0 |
| Exact Mass | 816.3968 Da |
| Heavy Atoms | 58 |
| Complexity | 1130.0 |
| SMILES | C1CCNCCCNC2=C3C=CC=C(C3=NC4=CC=CC=C42)CSCCNC(=O)CCC(=O)NCCSCC5=CC=CC6=C(C7=CC=CC=C7N=C56)NCCCNC1 |
| InChIKey | UVLHFJPFDUIGIB-UHFFFAOYSA-N |
Chemical Property Profile of Macrocyclic bisacridine
Property Insights of Macrocyclic bisacridine
The XLogP value of 6.5 indicates that Macrocyclic bisacridine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 183.0 Ų indicates high polarity, suggesting Macrocyclic bisacridine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Macrocyclic bisacridine has 6 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Macrocyclic bisacridine?
The CAS number of Macrocyclic bisacridine is 122332-78-9.
What is the molecular formula of Macrocyclic bisacridine?
The molecular formula of Macrocyclic bisacridine is C46H56N8O2S2.
What is the molecular weight of Macrocyclic bisacridine?
The molecular weight of Macrocyclic bisacridine is 816.3968 g/mol.
Where can I buy Macrocyclic bisacridine?
You can request a quote for Macrocyclic bisacridine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Macrocyclic bisacridine?
Yes, CoreyChem provides custom synthesis services for Macrocyclic bisacridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.