![dimethoxy[?]dione structure](/static/products/7141/71413-12-2.webp)
dimethoxy[?]dione
TL;DR: dimethoxy[?]dione (CAS 71413-12-2) is a chemical compound with molecular formula C20H22O4 and molecular weight 326.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
15,17-dimethoxytricyclo[11.3.1.15,9]octadeca-1(16),5,8,13(17),14-pentaene-7,18-dione
Also Known As: dimethoxy[?]dione, NCI60_003063, 15,17-Dimethoxytricyclo(11.3.1.1(5,9))octadeca-1(17),5,8,13,15-pentaene-7,18-dione, syn-15,18-Dimethoxy(2,6)-p-benzoquinonometacyclophane, 12-hydroxy-5-methyl-10,11-dihydro-5H-dibenzo[a,d]cyclohepten-5,10-imine
| Molecular Formula | C20H22O4 |
|---|---|
| Molecular Weight | 326.15 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 326.1518 |
| Heavy Atoms | 24 |
| Complexity | 518.0 |
Chemical Identifiers
| CAS Number | 71413-12-2 |
|---|---|
| SMILES | COC1=CC2=C(C(=C1)CCCC3=CC(=O)C=C(C3=O)CCC2)OC |
| InChIKey | VCEDWTLHLIZOJL-UHFFFAOYSA-N |
Product Overview
dimethoxy[?]dione (CAS 71413-12-2), with molecular formula C20H22O4 and molecular weight 326.15 g/mol. IUPAC: 15,17-dimethoxytricyclo[11.3.1.15,9]octadeca-1(16),5,8,13(17),14-pentaene-7,18-dione.
Chemical Property Profile of dimethoxy[?]dione
Property Insights of dimethoxy[?]dione
The XLogP value of 3.6 indicates that dimethoxy[?]dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, dimethoxy[?]dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, dimethoxy[?]dione has 0 hydrogen bond donor(s) and 4 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 dimethoxy[?]dione?
The CAS number of dimethoxy[?]dione is 71413-12-2.
What is the molecular formula of dimethoxy[?]dione?
The molecular formula of dimethoxy[?]dione is C20H22O4.
What is the molecular weight of dimethoxy[?]dione?
The molecular weight of dimethoxy[?]dione is 326.15 g/mol.
Where can I buy dimethoxy[?]dione?
You can request a quote for dimethoxy[?]dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for dimethoxy[?]dione?
Yes, KEHONG BIO provides custom synthesis services for dimethoxy[?]dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.