Dehydrodiscretamine
TL;DR: Dehydrodiscretamine (CAS 89560-99-6) is a chemical compound with molecular formula C19H18NO4+ and molecular weight 324.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Dehydrodiscretamine
2,9-dimethoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium-3,10-diol
Also Known As: Dehydrodiscretamine, 2,9-dimethoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium-3,10-diol, 2,9-dimethoxy-5,6-dihydroisoquinolino(2,1-b)isoquinolin-7-ium-3,10-diol, 10-hydroxy-2,9-dimethoxy-6,7-dihydro-5H-isoquinolino(2,1-b)isoquinolin-7-ium-3-one, 10-hydroxy-2,9-dimethoxy-6,7-dihydro-5H-isoquinolino[2,1-b]isoquinolin-7-ium-3-one
| Molecular Formula | C19H18NO4+ |
|---|---|
| Molecular Weight | 324.12 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 62.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 324.1236 |
| Heavy Atoms | 24 |
| Complexity | 447.0 |
Chemical Identifiers
| CAS Number | 89560-99-6 |
|---|---|
| SMILES | COC1=C(C=C2CC[N+]3=C(C2=C1)C=C4C=CC(=C(C4=C3)OC)O)O |
| InChIKey | XXLNLCVMHJBPLJ-UHFFFAOYSA-O |
Product Overview
Dehydrodiscretamine (CAS 89560-99-6), with molecular formula C19H18NO4+ and molecular weight 324.12 g/mol. IUPAC: 2,9-dimethoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium-3,10-diol.
Chemical Property Profile of Dehydrodiscretamine
Property Insights of Dehydrodiscretamine
The XLogP value of 3.1 indicates that Dehydrodiscretamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Dehydrodiscretamine. Following Lipinski's Rule of Five, Dehydrodiscretamine has 2 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 Dehydrodiscretamine?
The CAS number of Dehydrodiscretamine is 89560-99-6.
What is the molecular formula of Dehydrodiscretamine?
The molecular formula of Dehydrodiscretamine is C19H18NO4+.
What is the molecular weight of Dehydrodiscretamine?
The molecular weight of Dehydrodiscretamine is 324.12 g/mol.
Where can I buy Dehydrodiscretamine?
You can request a quote for Dehydrodiscretamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dehydrodiscretamine?
Yes, KEHONG BIO provides custom synthesis services for Dehydrodiscretamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.