Papaverine nicotinate
TL;DR: Papaverine nicotinate (CAS 1748-09-0) is a chemical compound with molecular formula C26H26N2O6 and molecular weight 462.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxyisoquinoline;pyridine-3-carboxylic acid
Also Known As: Papaverine nicotinate, NICOPAVIN, NIPAVINA, PANIVERIN, EINECS 217-132-1
| Molecular Formula | C26H26N2O6 |
|---|---|
| Molecular Weight | 462.18 g/mol |
| LogP | 4.6398 |
| Topological Polar Surface Area | 100.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 462.17908 |
| Heavy Atoms | 34 |
| Complexity | 1261.1133 |
Chemical Identifiers
| CAS Number | 1748-09-0 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CC2=NC=CC3=CC(=C(C=C32)OC)OC)OC.C1=CC(=CN=C1)C(=O)O |
Product Overview
Papaverine nicotinate (CAS 1748-09-0), with molecular formula C26H26N2O6 and molecular weight 462.18 g/mol. IUPAC: 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxyisoquinoline;pyridine-3-carboxylic acid.
Chemical Property Profile of Papaverine nicotinate
Property Insights of Papaverine nicotinate
The XLogP value of 4.6398 indicates that Papaverine nicotinate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Papaverine nicotinate. Following Lipinski's Rule of Five, Papaverine nicotinate has 1 hydrogen bond donor(s) and 7 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 Papaverine nicotinate?
The CAS number of Papaverine nicotinate is 1748-09-0.
What is the molecular formula of Papaverine nicotinate?
The molecular formula of Papaverine nicotinate is C26H26N2O6.
What is the molecular weight of Papaverine nicotinate?
The molecular weight of Papaverine nicotinate is 462.18 g/mol.
Where can I buy Papaverine nicotinate?
You can request a quote for Papaverine nicotinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Papaverine nicotinate?
Yes, KEHONG BIO provides custom synthesis services for Papaverine nicotinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.