Danshenxinkun B
TL;DR: Danshenxinkun B (CAS 65907-76-8) is a chemical compound with molecular formula C18H16O3 and molecular weight 280.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-hydroxy-8-methyl-2-propan-2-ylphenanthrene-3,4-dione
Also Known As: Danshenxinkun B, Danshexinkun B, Tanshiquinone B, HY-N6922, 1-hydroxy-8-methyl-2-propan-2-ylphenanthrene-3,4-dione
| Molecular Formula | C18H16O3 |
|---|---|
| Molecular Weight | 280.11 g/mol |
| LogP | 3.83872 |
| Topological Polar Surface Area | 54.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 280.10995 |
| Heavy Atoms | 21 |
| Complexity | 825.71747 |
Chemical Identifiers
| CAS Number | 65907-76-8 |
|---|---|
| SMILES | CC1=C2C=CC3=C(C2=CC=C1)C(=O)C(=O)C(=C3O)C(C)C |
Product Overview
Danshenxinkun B (CAS 65907-76-8), with molecular formula C18H16O3 and molecular weight 280.11 g/mol. IUPAC: 1-hydroxy-8-methyl-2-propan-2-ylphenanthrene-3,4-dione.
Chemical Property Profile of Danshenxinkun B
Property Insights of Danshenxinkun B
The XLogP value of 3.83872 indicates that Danshenxinkun B is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.37 Ų, Danshenxinkun B exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Danshenxinkun B has 1 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 Danshenxinkun B?
The CAS number of Danshenxinkun B is 65907-76-8.
What is the molecular formula of Danshenxinkun B?
The molecular formula of Danshenxinkun B is C18H16O3.
What is the molecular weight of Danshenxinkun B?
The molecular weight of Danshenxinkun B is 280.11 g/mol.
Where can I buy Danshenxinkun B?
You can request a quote for Danshenxinkun B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Danshenxinkun B?
Yes, KEHONG BIO provides custom synthesis services for Danshenxinkun B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.