Dauricine
TL;DR: Dauricine (CAS 5548-68-5) is a chemical compound with molecular formula C38H44N2O6 and molecular weight 624.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]-2-[4-[(6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]phenoxy]phenol
Also Known As: Dauricine, Dauricine [M+H]+, Menispermum dauricum DC Extract, indol-3-yl-glyoxylic acid amide, NCI60_003351
| Molecular Formula | C38H44N2O6 |
|---|---|
| Molecular Weight | 624.32 g/mol |
| LogP | 6.7 |
| Topological Polar Surface Area | 72.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 624.31995 |
| Heavy Atoms | 46 |
| Complexity | 933.0 |
Chemical Identifiers
| CAS Number | 5548-68-5 |
|---|---|
| SMILES | CN1CCC2=CC(=C(C=C2C1CC3=CC=C(C=C3)OC4=C(C=CC(=C4)CC5C6=CC(=C(C=C6CCN5C)OC)OC)O)OC)OC |
| InChIKey | AQASRZOCERRGBL-UHFFFAOYSA-N |
Product Overview
Dauricine (CAS 5548-68-5), with molecular formula C38H44N2O6 and molecular weight 624.32 g/mol. IUPAC: 4-[(6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]-2-[4-[(6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]phenoxy]phenol.
Chemical Property Profile of Dauricine
Property Insights of Dauricine
The XLogP value of 6.7 indicates that Dauricine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Dauricine. Following Lipinski's Rule of Five, Dauricine has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dauricine?
The CAS number of Dauricine is 5548-68-5.
What is the molecular formula of Dauricine?
The molecular formula of Dauricine is C38H44N2O6.
What is the molecular weight of Dauricine?
The molecular weight of Dauricine is 624.32 g/mol.
Where can I buy Dauricine?
You can request a quote for Dauricine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dauricine?
Yes, KEHONG BIO provides custom synthesis services for Dauricine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.