Decamethoxine
TL;DR: Decamethoxine (CAS 6270-47-9) is a chemical compound with molecular formula C38H74Cl2N2O4 and molecular weight 692.50 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10-[dimethyl-[2-(5-methyl-2-propan-2-ylcyclohexyl)oxy-2-oxoethyl]azaniumyl]decyl-dimethyl-[2-(5-methyl-2-propan-2-ylcyclohexyl)oxy-2-oxoethyl]azanium dichloride
Also Known As: Decamethoxine, Decamethoxin, decametoxin, Dekametoksin, MM 692; Septefril
| Molecular Formula | C38H74Cl2N2O4 |
|---|---|
| Molecular Weight | 692.50 g/mol |
| LogP | 2.276 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 21 |
| Exact Mass | 692.50256 |
| Heavy Atoms | 46 |
| Complexity | 771.0 |
Chemical Identifiers
| CAS Number | 6270-47-9 |
|---|---|
| SMILES | CC1CCC(C(C1)OC(=O)C[N+](C)(C)CCCCCCCCCC[N+](C)(C)CC(=O)OC2CC(CCC2C(C)C)C)C(C)C.[Cl-].[Cl-] |
| InChIKey | LRQIWRXCHWNNEA-UHFFFAOYSA-L |
Product Overview
Decamethoxine (CAS 6270-47-9), with molecular formula C38H74Cl2N2O4 and molecular weight 692.50 g/mol. IUPAC: 10-[dimethyl-[2-(5-methyl-2-propan-2-ylcyclohexyl)oxy-2-oxoethyl]azaniumyl]decyl-dimethyl-[2-(5-methyl-2-propan-2-ylcyclohexyl)oxy-2-oxoethyl]azanium dichloride.
Chemical Property Profile of Decamethoxine
Property Insights of Decamethoxine
The XLogP value of 2.276 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Decamethoxine. With a topological polar surface area (TPSA) of 52.6 Ų, Decamethoxine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Decamethoxine has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Decamethoxine?
The CAS number of Decamethoxine is 6270-47-9.
What is the molecular formula of Decamethoxine?
The molecular formula of Decamethoxine is C38H74Cl2N2O4.
What is the molecular weight of Decamethoxine?
The molecular weight of Decamethoxine is 692.50 g/mol.
Where can I buy Decamethoxine?
You can request a quote for Decamethoxine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Decamethoxine?
Yes, KEHONG BIO provides custom synthesis services for Decamethoxine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.