Darbufelone
TL;DR: Darbufelone (CAS 139226-30-5) is a chemical compound with molecular formula C18H24N2O2S and molecular weight 332.15585 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(5Z)-2-amino-5-[(3,5-ditert-butyl-4-hydroxyphenyl)methylidene]-1,3-thiazol-4-one
Also Known As: Darbufelone, darbufelona, darbufelonum, Darbufelone mesylate, Darbufelone [INN]
Technical Specifications
| Molecular Formula | C18H24N2O2S |
| Molecular Weight | 332.15585 g/mol |
| XLogP | 4.9 |
| Topological Polar Surface Area (TPSA) | 101.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 332.15585 Da |
| Heavy Atoms | 23 |
| Complexity | 516.0 |
| SMILES | CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)/C=C\2/C(=O)N=C(S2)N |
| InChIKey | AKTXOQVMWSFEBQ-LCYFTJDESA-N |
Chemical Property Profile of Darbufelone
Property Insights of Darbufelone
The XLogP value of 4.9 indicates that Darbufelone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Darbufelone. Following Lipinski's Rule of Five, Darbufelone has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Darbufelone?
The CAS number of Darbufelone is 139226-30-5.
What is the molecular formula of Darbufelone?
The molecular formula of Darbufelone is C18H24N2O2S.
What is the molecular weight of Darbufelone?
The molecular weight of Darbufelone is 332.15585 g/mol.
Where can I buy Darbufelone?
You can request a quote for Darbufelone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Darbufelone?
Yes, CoreyChem provides custom synthesis services for Darbufelone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.