Ditercalinium Chloride
TL;DR: Ditercalinium Chloride (CAS 74517-42-3) is a chemical compound with molecular formula C46H50Cl2N6O2 and molecular weight 788.3372 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
10-methoxy-2-[2-[4-[1-[2-(10-methoxy-7H-pyrido[4,3-c]carbazol-2-ium-2-yl)ethyl]piperidin-4-yl]piperidin-1-yl]ethyl]-7H-pyrido[4,3-c]carbazol-2-ium dichloride
Also Known As: Ditercalinium chloride, ditercalinium, Cloruro de ditercalinio, Ditercalinii chloridum, Chlorure de ditercalinium
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C46H50Cl2N6O2 |
| Molecular Weight | 788.3372 g/mol |
| XLogP | 1.99 |
| Topological Polar Surface Area (TPSA) | 64.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 788.3372 Da |
| Heavy Atoms | 56 |
| Complexity | 1130.0 |
| SMILES | COC1=CC2=C(C=C1)NC3=C2C4=C(C=C3)C=C[N+](=C4)CCN5CCC(CC5)C6CCN(CC6)CC[N+]7=CC8=C(C=CC9=C8C1=C(N9)C=CC(=C1)OC)C=C7.[Cl-].[Cl-] |
| InChIKey | FWBSWSRNGHRDFZ-UHFFFAOYSA-N |
Chemical Property Profile of Ditercalinium Chloride
Property Insights of Ditercalinium Chloride
The XLogP value of 1.99 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ditercalinium Chloride. The TPSA of 64.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Ditercalinium Chloride. Following Lipinski's Rule of Five, Ditercalinium Chloride has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Ditercalinium Chloride?
The CAS number of Ditercalinium Chloride is 74517-42-3.
What is the molecular formula of Ditercalinium Chloride?
The molecular formula of Ditercalinium Chloride is C46H50Cl2N6O2.
What is the molecular weight of Ditercalinium Chloride?
The molecular weight of Ditercalinium Chloride is 788.3372 g/mol.
Where can I buy Ditercalinium Chloride?
You can request a quote for Ditercalinium Chloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ditercalinium Chloride?
Yes, CoreyChem provides custom synthesis services for Ditercalinium Chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.