Cajanone
TL;DR: Cajanone (CAS 63006-48-4) is a chemical compound with molecular formula C25H26O6 and molecular weight 422.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[2,4-dihydroxy-5-(3-methylbut-2-enyl)phenyl]-5-hydroxy-2,2-dimethyl-7,8-dihydropyrano[3,2-g]chromen-6-one
Also Known As: CAJANONE, NCI60_002437, 2H,6H-Benzo(1,2-b:5,4-b')dipyran-6-one, 7-(2,4-dihydroxy-5-(3-methyl-2-buten-1-yl)phenyl)-7,8-dihydro-5-hydroxy-2,2-dimethyl-, 7-(2,4-Dihydroxy-5-(3-methyl-2-buten-1-yl)phenyl)-7,8-dihydro-5-hydroxy-2,2-dimethyl-2H,6H-benzo(1,2-b:5,4-b')dipyran-6-one, 7-[2,4-dihydroxy-5-(3-methylbut-2-enyl)phenyl]-5-hydroxy-2,2-dimethyl-7,8-dihydropyrano[3,2-g]chromen-6-one
| Molecular Formula | C25H26O6 |
|---|---|
| Molecular Weight | 422.17 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 96.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 422.17294 |
| Heavy Atoms | 31 |
| Complexity | 738.0 |
Chemical Identifiers
| CAS Number | 63006-48-4 |
|---|---|
| SMILES | CC(=CCC1=CC(=C(C=C1O)O)C2COC3=C(C2=O)C(=C4C=CC(OC4=C3)(C)C)O)C |
| InChIKey | BAKSOIVZFARRJC-UHFFFAOYSA-N |
Product Overview
Cajanone (CAS 63006-48-4), with molecular formula C25H26O6 and molecular weight 422.17 g/mol. IUPAC: 7-[2,4-dihydroxy-5-(3-methylbut-2-enyl)phenyl]-5-hydroxy-2,2-dimethyl-7,8-dihydropyrano[3,2-g]chromen-6-one.
Chemical Property Profile of Cajanone
Property Insights of Cajanone
The XLogP value of 5.4 indicates that Cajanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Cajanone. Following Lipinski's Rule of Five, Cajanone has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Cajanone?
The CAS number of Cajanone is 63006-48-4.
What is the molecular formula of Cajanone?
The molecular formula of Cajanone is C25H26O6.
What is the molecular weight of Cajanone?
The molecular weight of Cajanone is 422.17 g/mol.
Where can I buy Cajanone?
You can request a quote for Cajanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cajanone?
Yes, KEHONG BIO provides custom synthesis services for Cajanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.