Dagapamil
TL;DR: Dagapamil (CAS 85247-76-3) is a chemical compound with molecular formula C36H56N2O4 and molecular weight 580.42 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-[2-(3-methoxyphenyl)ethyl-methylamino]propyl]-2-(3,4,5-trimethoxyphenyl)tetradecanenitrile
Also Known As: Dagapamil, Dagapamilum, dagapamilo, Dagapamil [INN], (+-)-DAGAPAMIL
| Molecular Formula | C36H56N2O4 |
|---|---|
| Molecular Weight | 580.42 g/mol |
| LogP | 10.3 |
| Topological Polar Surface Area | 64.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 23 |
| Exact Mass | 580.424 |
| Heavy Atoms | 42 |
| Complexity | 712.0 |
Chemical Identifiers
| CAS Number | 85247-76-3 |
|---|---|
| SMILES | CCCCCCCCCCCCC(CCCN(C)CCC1=CC(=CC=C1)OC)(C#N)C2=CC(=C(C(=C2)OC)OC)OC |
| InChIKey | BGCVNLXQFOHWMO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dagapamil (CAS 85247-76-3), with molecular formula C36H56N2O4 and molecular weight 580.42 g/mol. IUPAC: 2-[3-[2-(3-methoxyphenyl)ethyl-methylamino]propyl]-2-(3,4,5-trimethoxyphenyl)tetradecanenitrile.
Chemical Property Profile of Dagapamil
Property Insights of Dagapamil
The XLogP value of 10.3 indicates that Dagapamil is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Dagapamil. Following Lipinski's Rule of Five, Dagapamil has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dagapamil?
The CAS number of Dagapamil is 85247-76-3.
What is the molecular formula of Dagapamil?
The molecular formula of Dagapamil is C36H56N2O4.
What is the molecular weight of Dagapamil?
The molecular weight of Dagapamil is 580.42 g/mol.
Where can I buy Dagapamil?
You can request a quote for Dagapamil directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dagapamil?
Yes, KEHONG BIO provides custom synthesis services for Dagapamil and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.