Deoxyartemsinin
TL;DR: Deoxyartemsinin (CAS 1349802-43-2) is a chemical compound with molecular formula C15H22O4 and molecular weight 266.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,4R,5S,8R,9S,12S)-12-hydroxy-4,8,12-trimethyl-2,13-dioxatricyclo[7.4.1.05,14]tetradec-6-en-3-one
Also Known As: Deoxyartemsinin, Deoxyartemisinin, Deoxy Artemisinin, 2-(4-methylphenyl)acetohydrazide, Deoxyartemsinin (metabolite of artemether)
| Molecular Formula | C15H22O4 |
|---|---|
| Molecular Weight | 266.15 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 266.1518 |
| Heavy Atoms | 19 |
| Complexity | 418.0 |
Chemical Identifiers
| CAS Number | 1349802-43-2 |
|---|---|
| SMILES | C[C@@H]1C=C[C@@H]2[C@H](C(=O)O[C@@H]3C2[C@H]1CC[C@@](O3)(C)O)C |
| InChIKey | ZHHCFKHSMKRNCX-CRBWWJEESA-N |
Product Overview
Deoxyartemsinin (CAS 1349802-43-2), with molecular formula C15H22O4 and molecular weight 266.15 g/mol. IUPAC: (1R,4R,5S,8R,9S,12S)-12-hydroxy-4,8,12-trimethyl-2,13-dioxatricyclo[7.4.1.05,14]tetradec-6-en-3-one.
Chemical Property Profile of Deoxyartemsinin
Property Insights of Deoxyartemsinin
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Deoxyartemsinin. With a topological polar surface area (TPSA) of 55.8 Ų, Deoxyartemsinin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Deoxyartemsinin has 1 hydrogen bond donor(s) and 4 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 Deoxyartemsinin?
The CAS number of Deoxyartemsinin is 1349802-43-2.
What is the molecular formula of Deoxyartemsinin?
The molecular formula of Deoxyartemsinin is C15H22O4.
What is the molecular weight of Deoxyartemsinin?
The molecular weight of Deoxyartemsinin is 266.15 g/mol.
Where can I buy Deoxyartemsinin?
You can request a quote for Deoxyartemsinin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Deoxyartemsinin?
Yes, KEHONG BIO provides custom synthesis services for Deoxyartemsinin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.