Dexetozoline
TL;DR: Dexetozoline (CAS 77519-25-6) is a chemical compound with molecular formula C13H20N2O3S and molecular weight 284.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (2Z)-2-[(5S)-3-methyl-4-oxo-5-piperidin-1-yl-1,3-thiazolidin-2-ylidene]acetate
Also Known As: Dexetozoline, Dexetozolinum, Dexetozolin, dexetozolina, Dexetozoline [INN]
| Molecular Formula | C13H20N2O3S |
|---|---|
| Molecular Weight | 284.12 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 75.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 284.11948 |
| Heavy Atoms | 19 |
| Complexity | 391.0 |
Chemical Identifiers
| CAS Number | 77519-25-6 |
|---|---|
| SMILES | CCOC(=O)/C=C\1/N(C(=O)[C@H](S1)N2CCCCC2)C |
| InChIKey | ZCKKHYXUQFTBIK-XPSMFNQNSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dexetozoline (CAS 77519-25-6), with molecular formula C13H20N2O3S and molecular weight 284.12 g/mol. IUPAC: ethyl (2Z)-2-[(5S)-3-methyl-4-oxo-5-piperidin-1-yl-1,3-thiazolidin-2-ylidene]acetate.
Chemical Property Profile of Dexetozoline
Property Insights of Dexetozoline
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dexetozoline. The TPSA of 75.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Dexetozoline. Following Lipinski's Rule of Five, Dexetozoline has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dexetozoline?
The CAS number of Dexetozoline is 77519-25-6.
What is the molecular formula of Dexetozoline?
The molecular formula of Dexetozoline is C13H20N2O3S.
What is the molecular weight of Dexetozoline?
The molecular weight of Dexetozoline is 284.12 g/mol.
Where can I buy Dexetozoline?
You can request a quote for Dexetozoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dexetozoline?
Yes, KEHONG BIO provides custom synthesis services for Dexetozoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.