8,8-Diethyldihydroberberine
TL;DR: 8,8-Diethyldihydroberberine (CAS 71266-78-9) is a chemical compound with molecular formula C24H27NO4 and molecular weight 393.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
14,14-diethyl-16,17-dimethoxy-5,7-dioxa-13-azapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-1(21),2,4(8),9,15(20),16,18-heptaene
Also Known As: 8,8-Diethyldihydroberberine, 8,8-diethyl 9,10-dimethoxy-5,8-dihydro-6H-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinoline, 8,8-Diethyl-9,10-dimethoxy-5,8-dihydro-2H,6H-[1,3]dioxolo[4,5-g]isoquinolino[3,2-a]isoquinoline
| Molecular Formula | C24H27NO4 |
|---|---|
| Molecular Weight | 393.19 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 40.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 393.194 |
| Heavy Atoms | 29 |
| Complexity | 632.0 |
Chemical Identifiers
| CAS Number | 71266-78-9 |
|---|---|
| SMILES | CCC1(C2=C(C=CC(=C2OC)OC)C=C3N1CCC4=CC5=C(C=C43)OCO5)CC |
| InChIKey | SYFIMBLBFVCFAG-UHFFFAOYSA-N |
Product Overview
8,8-Diethyldihydroberberine (CAS 71266-78-9), with molecular formula C24H27NO4 and molecular weight 393.19 g/mol. IUPAC: 14,14-diethyl-16,17-dimethoxy-5,7-dioxa-13-azapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-1(21),2,4(8),9,15(20),16,18-heptaene.
Chemical Property Profile of 8,8-Diethyldihydroberberine
Property Insights of 8,8-Diethyldihydroberberine
The XLogP value of 5.2 indicates that 8,8-Diethyldihydroberberine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.2 Ų, 8,8-Diethyldihydroberberine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8,8-Diethyldihydroberberine has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 8,8-Diethyldihydroberberine?
The CAS number of 8,8-Diethyldihydroberberine is 71266-78-9.
What is the molecular formula of 8,8-Diethyldihydroberberine?
The molecular formula of 8,8-Diethyldihydroberberine is C24H27NO4.
What is the molecular weight of 8,8-Diethyldihydroberberine?
The molecular weight of 8,8-Diethyldihydroberberine is 393.19 g/mol.
Where can I buy 8,8-Diethyldihydroberberine?
You can request a quote for 8,8-Diethyldihydroberberine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8,8-Diethyldihydroberberine?
Yes, KEHONG BIO provides custom synthesis services for 8,8-Diethyldihydroberberine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.