双罗布麻素
TL;DR: 双罗布麻素 (CAS 29799-22-2) is a chemical compound with molecular formula C18H18O6 and molecular weight 330.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
双罗布麻素
1-[3-(5-acetyl-2-hydroxy-3-methoxyphenyl)-4-hydroxy-5-methoxyphenyl]ethanone
Also Known As: diapocynin, Dehydrodiacetovanillone, Apocynin dimer, 6,6 -Bi(4-acetyl-2-methoxyphenol), SID:160657184
| Molecular Formula | C18H18O6 |
|---|---|
| Molecular Weight | 330.11 g/mol |
| LogP | 3.1872 |
| Topological Polar Surface Area | 93.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 330.11035 |
| Heavy Atoms | 24 |
| Complexity | 753.2441 |
Chemical Identifiers
| CAS Number | 29799-22-2 |
|---|---|
| SMILES | CC(=O)C1=CC(=C(C(=C1)OC)O)C2=C(C(=CC(=C2)C(=O)C)OC)O |
Product Overview
双罗布麻素 (CAS 29799-22-2), with molecular formula C18H18O6 and molecular weight 330.11 g/mol. IUPAC: 1-[3-(5-acetyl-2-hydroxy-3-methoxyphenyl)-4-hydroxy-5-methoxyphenyl]ethanone.
Chemical Property Profile of 双罗布麻素
Property Insights of 双罗布麻素
The XLogP value of 3.1872 indicates that 双罗布麻素 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 双罗布麻素. Following Lipinski's Rule of Five, 双罗布麻素 has 2 hydrogen bond donor(s) and 6 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 双罗布麻素?
The CAS number of 双罗布麻素 is 29799-22-2.
What is the molecular formula of 双罗布麻素?
The molecular formula of 双罗布麻素 is C18H18O6.
What is the molecular weight of 双罗布麻素?
The molecular weight of 双罗布麻素 is 330.11 g/mol.
Where can I buy 双罗布麻素?
You can request a quote for 双罗布麻素 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 双罗布麻素?
Yes, KEHONG BIO provides custom synthesis services for 双罗布麻素 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.