Castillene D
TL;DR: Castillene D (CAS 126585-63-5) is a chemical compound with molecular formula C19H14O6 and molecular weight 338.07904 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(1,3-benzodioxol-5-ylmethyl)-2-methoxyfuro[2,3-e][1]benzofuran-3-one
Also Known As: Castillene D, (+)-Castillene D, 2-(1,3-benzodioxol-5-ylmethyl)-2-methoxyfuro[2,3-e][1]benzofuran-3-one, 2-(1,3-benzodioxol-5-ylmethyl)-2-methoxyfuro(2,3-e)(1)benzofuran-3-one, 2-[(1,3-Benzodioxol-5-yl)methyl]-2-methoxybenzo[1,2-b:3,4-b ]difuran-3(2H)-one
Technical Specifications
| Molecular Formula | C19H14O6 |
| Molecular Weight | 338.07904 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 67.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 338.07904 Da |
| Heavy Atoms | 25 |
| Complexity | 538.0 |
| SMILES | COC1(C(=O)C2=C(O1)C3=C(C=C2)OC=C3)CC4=CC5=C(C=C4)OCO5 |
| InChIKey | HNGNYODKSMNHQW-UHFFFAOYSA-N |
Chemical Property Profile of Castillene D
Property Insights of Castillene D
The XLogP value of 3.5 indicates that Castillene D is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Castillene D. Following Lipinski's Rule of Five, Castillene D has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Castillene D?
The CAS number of Castillene D is 126585-63-5.
What is the molecular formula of Castillene D?
The molecular formula of Castillene D is C19H14O6.
What is the molecular weight of Castillene D?
The molecular weight of Castillene D is 338.07904 g/mol.
Where can I buy Castillene D?
You can request a quote for Castillene D directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Castillene D?
Yes, CoreyChem provides custom synthesis services for Castillene D and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.