Asterriquinone
TL;DR: Asterriquinone (CAS 60696-52-8) is a chemical compound with molecular formula C32H30N2O4 and molecular weight 506.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-dihydroxy-3,6-bis[1-(2-methylbut-3-en-2-yl)indol-3-yl]cyclohexa-2,5-diene-1,4-dione
Also Known As: Asterriquinone, Demethylasterriquinone A1, Demethyl-asterriquinone A1, HY-N14349, NCI60_002372
| Molecular Formula | C32H30N2O4 |
|---|---|
| Molecular Weight | 506.22 g/mol |
| LogP | 5.8 |
| Topological Polar Surface Area | 84.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 506.22055 |
| Heavy Atoms | 38 |
| Complexity | 1010.0 |
Chemical Identifiers
| CAS Number | 60696-52-8 |
|---|---|
| SMILES | CC(C)(C=C)N1C=C(C2=CC=CC=C21)C3=C(C(=O)C(=C(C3=O)O)C4=CN(C5=CC=CC=C54)C(C)(C)C=C)O |
| InChIKey | KMHWTYMNRHJTQG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Asterriquinone (CAS 60696-52-8), with molecular formula C32H30N2O4 and molecular weight 506.22 g/mol. IUPAC: 2,5-dihydroxy-3,6-bis[1-(2-methylbut-3-en-2-yl)indol-3-yl]cyclohexa-2,5-diene-1,4-dione.
Chemical Property Profile of Asterriquinone
Property Insights of Asterriquinone
The XLogP value of 5.8 indicates that Asterriquinone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Asterriquinone. Following Lipinski's Rule of Five, Asterriquinone has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Asterriquinone?
The CAS number of Asterriquinone is 60696-52-8.
What is the molecular formula of Asterriquinone?
The molecular formula of Asterriquinone is C32H30N2O4.
What is the molecular weight of Asterriquinone?
The molecular weight of Asterriquinone is 506.22 g/mol.
Where can I buy Asterriquinone?
You can request a quote for Asterriquinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Asterriquinone?
Yes, KEHONG BIO provides custom synthesis services for Asterriquinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.