Dianellinone
TL;DR: Dianellinone (CAS 1991-29-3) is a chemical compound with molecular formula C26H18O8 and molecular weight 458.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-acetyl-2-(7-acetyl-8-hydroxy-6-methyl-1,4-dioxonaphthalen-2-yl)-8-hydroxy-6-methylnaphthalene-1,4-dione
Also Known As: Dianellinone, 7-acetyl-2-(7-acetyl-8-hydroxy-6-methyl-1,4-dioxonaphthalen-2-yl)-8-hydroxy-6-methylnaphthalene-1,4-dione, (2,2'-Binaphthalene)-1,1',4,4'-tetrone, 7,7'-diacetyl-8,8'-dihydroxy-6,6'-dimethyl-, 7,7'-Diacetyl-8,8'-dihydroxy-6,6'-dimethyl[2,2'-binaphthalene]-1,1',4,4'-tetrone, 7,7/'-Diacetyl-8,8/'-dihydroxy-6,6/'-dimethyl-2,2/'-binaphthalene-1,1/',4,4/'-tetrone
| Molecular Formula | C26H18O8 |
|---|---|
| Molecular Weight | 458.10 g/mol |
| LogP | 3.43084 |
| Topological Polar Surface Area | 142.88 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 458.10016 |
| Heavy Atoms | 34 |
| Complexity | 1384.1196 |
Chemical Identifiers
| CAS Number | 1991-29-3 |
|---|---|
| SMILES | CC1=CC2=C(C(=C1C(=O)C)O)C(=O)C(=CC2=O)C3=CC(=O)C4=C(C3=O)C(=C(C(=C4)C)C(=O)C)O |
Product Overview
Dianellinone (CAS 1991-29-3), with molecular formula C26H18O8 and molecular weight 458.10 g/mol. IUPAC: 7-acetyl-2-(7-acetyl-8-hydroxy-6-methyl-1,4-dioxonaphthalen-2-yl)-8-hydroxy-6-methylnaphthalene-1,4-dione.
Chemical Property Profile of Dianellinone
Property Insights of Dianellinone
The XLogP value of 3.43084 indicates that Dianellinone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 142.88 Ų indicates high polarity, suggesting Dianellinone may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Dianellinone has 2 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 Dianellinone?
The CAS number of Dianellinone is 1991-29-3.
What is the molecular formula of Dianellinone?
The molecular formula of Dianellinone is C26H18O8.
What is the molecular weight of Dianellinone?
The molecular weight of Dianellinone is 458.10 g/mol.
Where can I buy Dianellinone?
You can request a quote for Dianellinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dianellinone?
Yes, KEHONG BIO provides custom synthesis services for Dianellinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.