CTK8D8626
TL;DR: CTK8D8626 (CAS 97583-07-8) is a chemical compound with molecular formula C46H94N2O12S2 and molecular weight 930.62 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl hydrogen sulfate;2-[4-(2-octadecanoyloxyethyl)piperazin-1-yl]ethyl octadecanoate
Also Known As: piperazine-1,4-diyldiethane-2,1-diyl dioctadecanoate- methyl hydrogen sulfate(1:2), 1,4-Dimethyl-1,4-bis(2-(stearoyloxy)ethyl)piperazindiium S,S'-dimethyl disulphate, methyl hydrogen sulfate; 2-[4-(2-octadecanoyloxyethyl)piperazin-1-yl]ethyl octadecanoate, Piperazinium, 1,4-dimethyl-1,4-bis(2-((1-oxooctadecyl)oxy)ethyl)-, bis(methyl sulfate), Piperazinium, 1,4-dimethyl-1,4-bis(2-((1-oxooctadecyl)oxy)ethyl)-, methyl sulfate (1:2)
| Molecular Formula | C46H94N2O12S2 |
|---|---|
| Molecular Weight | 930.62 g/mol |
| LogP | 11.08 |
| Topological Polar Surface Area | 203.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 42 |
| Exact Mass | 930.6248 |
| Heavy Atoms | 62 |
| Complexity | 769.0 |
Chemical Identifiers
| CAS Number | 97583-07-8 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCC(=O)OCCN1CCN(CC1)CCOC(=O)CCCCCCCCCCCCCCCCC.COS(=O)(=O)O.COS(=O)(=O)O |
| InChIKey | WZEZDOUFBCEKFV-UHFFFAOYSA-N |
Product Overview
CTK8D8626 (CAS 97583-07-8), with molecular formula C46H94N2O12S2 and molecular weight 930.62 g/mol. IUPAC: methyl hydrogen sulfate;2-[4-(2-octadecanoyloxyethyl)piperazin-1-yl]ethyl octadecanoate.
Chemical Property Profile of CTK8D8626
Property Insights of CTK8D8626
The XLogP value of 11.08 indicates that CTK8D8626 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 203.0 Ų indicates high polarity, suggesting CTK8D8626 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, CTK8D8626 has 2 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CTK8D8626?
The CAS number of CTK8D8626 is 97583-07-8.
What is the molecular formula of CTK8D8626?
The molecular formula of CTK8D8626 is C46H94N2O12S2.
What is the molecular weight of CTK8D8626?
The molecular weight of CTK8D8626 is 930.62 g/mol.
Where can I buy CTK8D8626?
You can request a quote for CTK8D8626 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK8D8626?
Yes, KEHONG BIO provides custom synthesis services for CTK8D8626 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.