parthenolide
TL;DR: parthenolide (CAS 29552-41-8) is a chemical compound with molecular formula C15H20O3 and molecular weight 248.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,2R,4R,7E,11S)-4,8-dimethyl-12-methylidene-3,14-dioxatricyclo[9.3.0.02,4]tetradec-7-en-13-one
Also Known As: parthenolide, (-)-Parthenolide, partenolide, Parthenolide?, Parthenolide CRS
| Molecular Formula | C15H20O3 |
|---|---|
| Molecular Weight | 248.14 g/mol |
| LogP | 2.762 |
| Topological Polar Surface Area | 38.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 248.14125 |
| Heavy Atoms | 18 |
| Complexity | 437.01965 |
Chemical Identifiers
| CAS Number | 29552-41-8 |
|---|---|
| SMILES | C/C/1=C\CC[C@@]2([C@H](O2)[C@@H]3[C@@H](CC1)C(=C)C(=O)O3)C |
Product Overview
parthenolide (CAS 29552-41-8), with molecular formula C15H20O3 and molecular weight 248.14 g/mol. IUPAC: (1S,2R,4R,7E,11S)-4,8-dimethyl-12-methylidene-3,14-dioxatricyclo[9.3.0.02,4]tetradec-7-en-13-one.
Chemical Property Profile of parthenolide
Property Insights of parthenolide
The XLogP value of 2.762 suggests moderate lipophilicity, balancing water solubility and membrane permeability for parthenolide. With a topological polar surface area (TPSA) of 38.83 Ų, parthenolide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, parthenolide has 0 hydrogen bond donor(s) and 3 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 parthenolide?
The CAS number of parthenolide is 29552-41-8.
What is the molecular formula of parthenolide?
The molecular formula of parthenolide is C15H20O3.
What is the molecular weight of parthenolide?
The molecular weight of parthenolide is 248.14 g/mol.
Where can I buy parthenolide?
You can request a quote for parthenolide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for parthenolide?
Yes, KEHONG BIO provides custom synthesis services for parthenolide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.