2-Methoxystypandrone
TL;DR: 2-Methoxystypandrone (CAS 85122-21-0) is a chemical compound with molecular formula C14H12O5 and molecular weight 260.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-acetyl-5-hydroxy-2-methoxy-7-methylnaphthalene-1,4-dione
Also Known As: 2-Methoxystypandrone, 2-Methoxy-6-acetyl-7-methyljuglone, 6-acetyl-5-hydroxy-2-methoxy-7-methylnaphthalene-1,4-dione, 2-Methoxy-6-acethyl-7-methyljuglone, 6-acetyl-5-hydroxy-2-methoxy-7-methyl-naphthalene-1,4-dione
| Molecular Formula | C14H12O5 |
|---|---|
| Molecular Weight | 260.07 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 80.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 260.06848 |
| Heavy Atoms | 19 |
| Complexity | 464.0 |
| Melting Point | 187 °C |
Chemical Identifiers
| CAS Number | 85122-21-0 |
|---|---|
| SMILES | CC1=CC2=C(C(=O)C=C(C2=O)OC)C(=C1C(=O)C)O |
| InChIKey | SSHJHOVVYKCJJI-UHFFFAOYSA-N |
Product Overview
2-Methoxystypandrone (CAS 85122-21-0), with molecular formula C14H12O5 and molecular weight 260.07 g/mol. IUPAC: 6-acetyl-5-hydroxy-2-methoxy-7-methylnaphthalene-1,4-dione.
Chemical Property Profile of 2-Methoxystypandrone
Property Insights of 2-Methoxystypandrone
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methoxystypandrone. The TPSA of 80.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methoxystypandrone. Following Lipinski's Rule of Five, 2-Methoxystypandrone has 1 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 2-Methoxystypandrone?
The CAS number of 2-Methoxystypandrone is 85122-21-0.
What is the molecular formula of 2-Methoxystypandrone?
The molecular formula of 2-Methoxystypandrone is C14H12O5.
What is the molecular weight of 2-Methoxystypandrone?
The molecular weight of 2-Methoxystypandrone is 260.07 g/mol.
Where can I buy 2-Methoxystypandrone?
You can request a quote for 2-Methoxystypandrone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methoxystypandrone?
Yes, KEHONG BIO provides custom synthesis services for 2-Methoxystypandrone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.