N-Desmethylverapamil
TL;DR: N-Desmethylverapamil (CAS 77326-93-3) is a chemical compound with molecular formula C26H36N2O4 and molecular weight 440.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-dimethoxyphenyl)-5-[2-(4-hydroxy-3-methoxyphenyl)ethyl-methylamino]-2-propan-2-ylpentanenitrile
Also Known As: p-O-Desmethyl Verapamil, N-Desmethylverapamil, Verapamil Impurity 35, Verapamil Impurity 36, P-O-DESMETHYLVERAPAMIL
| Molecular Formula | C26H36N2O4 |
|---|---|
| Molecular Weight | 440.27 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 75.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 12 |
| Exact Mass | 440.26752 |
| Heavy Atoms | 32 |
| Complexity | 592.0 |
Chemical Identifiers
| CAS Number | 77326-93-3 |
|---|---|
| SMILES | CC(C)C(CCCN(C)CCC1=CC(=C(C=C1)O)OC)(C#N)C2=CC(=C(C=C2)OC)OC |
| InChIKey | CAAKRPRWCVWYAO-UHFFFAOYSA-N |
Product Overview
N-Desmethylverapamil (CAS 77326-93-3), with molecular formula C26H36N2O4 and molecular weight 440.27 g/mol. IUPAC: 2-(3,4-dimethoxyphenyl)-5-[2-(4-hydroxy-3-methoxyphenyl)ethyl-methylamino]-2-propan-2-ylpentanenitrile.
Chemical Property Profile of N-Desmethylverapamil
Property Insights of N-Desmethylverapamil
The XLogP value of 3.5 indicates that N-Desmethylverapamil is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Desmethylverapamil. Following Lipinski's Rule of Five, N-Desmethylverapamil has 1 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 N-Desmethylverapamil?
The CAS number of N-Desmethylverapamil is 77326-93-3.
What is the molecular formula of N-Desmethylverapamil?
The molecular formula of N-Desmethylverapamil is C26H36N2O4.
What is the molecular weight of N-Desmethylverapamil?
The molecular weight of N-Desmethylverapamil is 440.27 g/mol.
Where can I buy N-Desmethylverapamil?
You can request a quote for N-Desmethylverapamil directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Desmethylverapamil?
Yes, KEHONG BIO provides custom synthesis services for N-Desmethylverapamil and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.