4-Demethoxy-4-isopropoxy-daunomycinon
TL;DR: 4-Demethoxy-4-isopropoxy-daunomycinon (CAS 67665-69-4) is a chemical compound with molecular formula C23H22O8 and molecular weight 426.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-acetyl-6,7,9,11-tetrahydroxy-4-propan-2-yloxy-8,10-dihydro-7H-tetracene-5,12-dione
Also Known As: 4-Demethoxy-4-isopropoxy-daunomycinon, 9-acetyl-6,7,9,11-tetrahydroxy-4-propan-2-yloxy-8,10-dihydro-7H-tetracene-5,12-dione, 8-Acetyl-6,8,10,11-tetrahydroxy-1-[(propan-2-yl)oxy]-7,8,9,10-tetrahydrotetracene-5,12-dione, 8-acetyl-6,8,10,11-tetrahydroxy-1-propan-2-yloxy-9,10-dihydro-7H-tetracene-5,12-dione
| Molecular Formula | C23H22O8 |
|---|---|
| Molecular Weight | 426.13 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 141.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 426.13147 |
| Heavy Atoms | 31 |
| Complexity | 765.0 |
Chemical Identifiers
| CAS Number | 67665-69-4 |
|---|---|
| SMILES | CC(C)OC1=CC=CC2=C1C(=O)C3=C(C4=C(CC(CC4O)(C(=O)C)O)C(=C3C2=O)O)O |
| InChIKey | JFNUARLCRGTYBI-UHFFFAOYSA-N |
Product Overview
4-Demethoxy-4-isopropoxy-daunomycinon (CAS 67665-69-4), with molecular formula C23H22O8 and molecular weight 426.13 g/mol. IUPAC: 9-acetyl-6,7,9,11-tetrahydroxy-4-propan-2-yloxy-8,10-dihydro-7H-tetracene-5,12-dione.
Chemical Property Profile of 4-Demethoxy-4-isopropoxy-daunomycinon
Property Insights of 4-Demethoxy-4-isopropoxy-daunomycinon
The XLogP value of 3.0 indicates that 4-Demethoxy-4-isopropoxy-daunomycinon is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 141.0 Ų indicates high polarity, suggesting 4-Demethoxy-4-isopropoxy-daunomycinon may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4-Demethoxy-4-isopropoxy-daunomycinon has 4 hydrogen bond donor(s) and 8 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 4-Demethoxy-4-isopropoxy-daunomycinon?
The CAS number of 4-Demethoxy-4-isopropoxy-daunomycinon is 67665-69-4.
What is the molecular formula of 4-Demethoxy-4-isopropoxy-daunomycinon?
The molecular formula of 4-Demethoxy-4-isopropoxy-daunomycinon is C23H22O8.
What is the molecular weight of 4-Demethoxy-4-isopropoxy-daunomycinon?
The molecular weight of 4-Demethoxy-4-isopropoxy-daunomycinon is 426.13 g/mol.
Where can I buy 4-Demethoxy-4-isopropoxy-daunomycinon?
You can request a quote for 4-Demethoxy-4-isopropoxy-daunomycinon directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Demethoxy-4-isopropoxy-daunomycinon?
Yes, KEHONG BIO provides custom synthesis services for 4-Demethoxy-4-isopropoxy-daunomycinon and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.