3-Acetyl-1,6,11-trihydroxy-10-methoxytetracene-5,12-dione
TL;DR: 3-Acetyl-1,6,11-trihydroxy-10-methoxytetracene-5,12-dione (CAS 20982-41-6) is a chemical compound with molecular formula C21H14O7 and molecular weight 378.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-acetyl-1,6,11-trihydroxy-10-methoxytetracene-5,12-dione
Also Known As: Doxorubicin Impurity 8, Daunorubicin Impurity 18, 3-acetyl-1,6,11-trihydroxy-10-methoxytetracene-5,12-dione, 2-acetyl-6,10,11-trihydroxy-1-methoxytetracene-5,12-dione, 8-Acetyl-6,10,11-trihydroxy-1-methoxy-5,12-naphthacenedione
| Molecular Formula | C21H14O7 |
|---|---|
| Molecular Weight | 378.07 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 121.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 378.07394 |
| Heavy Atoms | 28 |
| Complexity | 676.0 |
Chemical Identifiers
| CAS Number | 20982-41-6 |
|---|---|
| SMILES | CC(=O)C1=CC2=C(C(=C1)O)C(=O)C3=C(C4=C(C=CC=C4OC)C(=C3C2=O)O)O |
| InChIKey | HKHNHEFBYGYLQM-UHFFFAOYSA-N |
Product Overview
3-Acetyl-1,6,11-trihydroxy-10-methoxytetracene-5,12-dione (CAS 20982-41-6), with molecular formula C21H14O7 and molecular weight 378.07 g/mol. IUPAC: 3-acetyl-1,6,11-trihydroxy-10-methoxytetracene-5,12-dione.
Chemical Property Profile of 3-Acetyl-1,6,11-trihydroxy-10-methoxytetracene-5,12-dione
Property Insights of 3-Acetyl-1,6,11-trihydroxy-10-methoxytetracene-5,12-dione
The XLogP value of 3.8 indicates that 3-Acetyl-1,6,11-trihydroxy-10-methoxytetracene-5,12-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Acetyl-1,6,11-trihydroxy-10-methoxytetracene-5,12-dione. Following Lipinski's Rule of Five, 3-Acetyl-1,6,11-trihydroxy-10-methoxytetracene-5,12-dione has 3 hydrogen bond donor(s) and 7 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 3-Acetyl-1,6,11-trihydroxy-10-methoxytetracene-5,12-dione?
The CAS number of 3-Acetyl-1,6,11-trihydroxy-10-methoxytetracene-5,12-dione is 20982-41-6.
What is the molecular formula of 3-Acetyl-1,6,11-trihydroxy-10-methoxytetracene-5,12-dione?
The molecular formula of 3-Acetyl-1,6,11-trihydroxy-10-methoxytetracene-5,12-dione is C21H14O7.
What is the molecular weight of 3-Acetyl-1,6,11-trihydroxy-10-methoxytetracene-5,12-dione?
The molecular weight of 3-Acetyl-1,6,11-trihydroxy-10-methoxytetracene-5,12-dione is 378.07 g/mol.
Where can I buy 3-Acetyl-1,6,11-trihydroxy-10-methoxytetracene-5,12-dione?
You can request a quote for 3-Acetyl-1,6,11-trihydroxy-10-methoxytetracene-5,12-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Acetyl-1,6,11-trihydroxy-10-methoxytetracene-5,12-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-Acetyl-1,6,11-trihydroxy-10-methoxytetracene-5,12-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.