3-Methoxy-2-methyl-2,5,7-trihydroxy-3,4-dihydro-1,6,11(2H)-naphthacenetrione
TL;DR: 3-Methoxy-2-methyl-2,5,7-trihydroxy-3,4-dihydro-1,6,11(2H)-naphthacenetrione (CAS 68178-51-8) is a chemical compound with molecular formula C20H16O7 and molecular weight 368.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5,7-trihydroxy-3-methoxy-2-methyl-3,4-dihydrotetracene-1,6,11-trione
Also Known As: Antibiotic SM 173B, Antibiotic SM-173B, 3-Methoxy-2-methyl-2,5,7-trihydroxy-3,4-dihydro-1,6,11(2H)-naphthacenetrione, 1,6,11(2H)-Naphthacenetrione, 3,4-dihydro-2,5,7-trihydroxy-3-methoxy-2-methyl-, 2,5,7-trihydroxy-3-methoxy-2-methyl-3,4-dihydrotetracene-1,6,11-trione
| Molecular Formula | C20H16O7 |
|---|---|
| Molecular Weight | 368.09 g/mol |
| LogP | 1.378 |
| Topological Polar Surface Area | 121.13 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 368.0896 |
| Heavy Atoms | 27 |
| Complexity | 1048.7811 |
Chemical Identifiers
| CAS Number | 68178-51-8 |
|---|---|
| SMILES | CC1(C(CC2=C(C3=C(C=C2C1=O)C(=O)C4=C(C3=O)C(=CC=C4)O)O)OC)O |
Product Overview
3-Methoxy-2-methyl-2,5,7-trihydroxy-3,4-dihydro-1,6,11(2H)-naphthacenetrione (CAS 68178-51-8), with molecular formula C20H16O7 and molecular weight 368.09 g/mol. IUPAC: 2,5,7-trihydroxy-3-methoxy-2-methyl-3,4-dihydrotetracene-1,6,11-trione.
Chemical Property Profile of 3-Methoxy-2-methyl-2,5,7-trihydroxy-3,4-dihydro-1,6,11(2H)-naphthacenetrione
Property Insights of 3-Methoxy-2-methyl-2,5,7-trihydroxy-3,4-dihydro-1,6,11(2H)-naphthacenetrione
The XLogP value of 1.378 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methoxy-2-methyl-2,5,7-trihydroxy-3,4-dihydro-1,6,11(2H)-naphthacenetrione. The TPSA of 121.13 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Methoxy-2-methyl-2,5,7-trihydroxy-3,4-dihydro-1,6,11(2H)-naphthacenetrione. Following Lipinski's Rule of Five, 3-Methoxy-2-methyl-2,5,7-trihydroxy-3,4-dihydro-1,6,11(2H)-naphthacenetrione 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-Methoxy-2-methyl-2,5,7-trihydroxy-3,4-dihydro-1,6,11(2H)-naphthacenetrione?
The CAS number of 3-Methoxy-2-methyl-2,5,7-trihydroxy-3,4-dihydro-1,6,11(2H)-naphthacenetrione is 68178-51-8.
What is the molecular formula of 3-Methoxy-2-methyl-2,5,7-trihydroxy-3,4-dihydro-1,6,11(2H)-naphthacenetrione?
The molecular formula of 3-Methoxy-2-methyl-2,5,7-trihydroxy-3,4-dihydro-1,6,11(2H)-naphthacenetrione is C20H16O7.
What is the molecular weight of 3-Methoxy-2-methyl-2,5,7-trihydroxy-3,4-dihydro-1,6,11(2H)-naphthacenetrione?
The molecular weight of 3-Methoxy-2-methyl-2,5,7-trihydroxy-3,4-dihydro-1,6,11(2H)-naphthacenetrione is 368.09 g/mol.
Where can I buy 3-Methoxy-2-methyl-2,5,7-trihydroxy-3,4-dihydro-1,6,11(2H)-naphthacenetrione?
You can request a quote for 3-Methoxy-2-methyl-2,5,7-trihydroxy-3,4-dihydro-1,6,11(2H)-naphthacenetrione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methoxy-2-methyl-2,5,7-trihydroxy-3,4-dihydro-1,6,11(2H)-naphthacenetrione?
Yes, KEHONG BIO provides custom synthesis services for 3-Methoxy-2-methyl-2,5,7-trihydroxy-3,4-dihydro-1,6,11(2H)-naphthacenetrione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.