CTK8J7522
TL;DR: CTK8J7522 (CAS 63654-52-4) is a chemical compound with molecular formula C22H42N2O9S and molecular weight 510.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-amino-2-oxoethyl)-[2-(3-carboxyprop-2-enoyloxy)ethyl]-dimethylazanium;dodecyl sulfate
Also Known As: Ethanaminium, 2-amino-N-[2-[[(2Z)-3-carboxy-1-oxo-2-propenyl]oxy]ethyl]-N,N-dimethyl-2-oxo-, dodecyl sulfate
| Molecular Formula | C22H42N2O9S |
|---|---|
| Molecular Weight | 510.26 g/mol |
| LogP | 2.12 |
| Topological Polar Surface Area | 182.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 19 |
| Exact Mass | 510.2611 |
| Heavy Atoms | 34 |
| Complexity | 566.0 |
Chemical Identifiers
| CAS Number | 63654-52-4 |
|---|---|
| SMILES | CCCCCCCCCCCCOS(=O)(=O)[O-].C[N+](C)(CCOC(=O)C=CC(=O)O)CC(=O)N |
| InChIKey | MRPTYZHWQNTLIT-UHFFFAOYSA-N |
Product Overview
CTK8J7522 (CAS 63654-52-4), with molecular formula C22H42N2O9S and molecular weight 510.26 g/mol. IUPAC: (2-amino-2-oxoethyl)-[2-(3-carboxyprop-2-enoyloxy)ethyl]-dimethylazanium;dodecyl sulfate.
Chemical Property Profile of CTK8J7522
Property Insights of CTK8J7522
The XLogP value of 2.12 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CTK8J7522. The TPSA of 182.0 Ų indicates high polarity, suggesting CTK8J7522 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, CTK8J7522 has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CTK8J7522?
The CAS number of CTK8J7522 is 63654-52-4.
What is the molecular formula of CTK8J7522?
The molecular formula of CTK8J7522 is C22H42N2O9S.
What is the molecular weight of CTK8J7522?
The molecular weight of CTK8J7522 is 510.26 g/mol.
Where can I buy CTK8J7522?
You can request a quote for CTK8J7522 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK8J7522?
Yes, KEHONG BIO provides custom synthesis services for CTK8J7522 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.