Protopapaverine
TL;DR: Protopapaverine (CAS 20975-09-1) is a chemical compound with molecular formula C19H19NO4 and molecular weight 325.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(3,4-dimethoxyphenyl)methyl]-7-hydroxy-2-methylisoquinolin-6-one
Also Known As: Protopapaverine, 1-((3,4-Dimethoxyphenyl)methyl)-7-hydroxy-2-methyl-2H-isoquinolin-6-one, 1-(3,4-DIMETHOXYBENZYL)-7-HYDROXY-2-METHYLISOQUINOLIN-6(2H)-ONE, 1-[(3,4-Dimethoxyphenyl)methyl]-7-hydroxy-2-methylisoquinolin-6(2H)-one, 1-((3,4-DIMETHOXYPHENYL)METHYL)-7-HYDROXY-2-METHYL-6(2H)-ISOQUINOLINONE
| Molecular Formula | C19H19NO4 |
|---|---|
| Molecular Weight | 325.13 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 59.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 325.1314 |
| Heavy Atoms | 24 |
| Complexity | 644.0 |
Chemical Identifiers
| CAS Number | 20975-09-1 |
|---|---|
| SMILES | CN1C=CC2=CC(=O)C(=CC2=C1CC3=CC(=C(C=C3)OC)OC)O |
| InChIKey | WBMGWJGLUWZFEE-UHFFFAOYSA-N |
Product Overview
Protopapaverine (CAS 20975-09-1), with molecular formula C19H19NO4 and molecular weight 325.13 g/mol. IUPAC: 1-[(3,4-dimethoxyphenyl)methyl]-7-hydroxy-2-methylisoquinolin-6-one.
Chemical Property Profile of Protopapaverine
Property Insights of Protopapaverine
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Protopapaverine. With a topological polar surface area (TPSA) of 59.0 Ų, Protopapaverine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Protopapaverine has 1 hydrogen bond donor(s) and 5 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 Protopapaverine?
The CAS number of Protopapaverine is 20975-09-1.
What is the molecular formula of Protopapaverine?
The molecular formula of Protopapaverine is C19H19NO4.
What is the molecular weight of Protopapaverine?
The molecular weight of Protopapaverine is 325.13 g/mol.
Where can I buy Protopapaverine?
You can request a quote for Protopapaverine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Protopapaverine?
Yes, KEHONG BIO provides custom synthesis services for Protopapaverine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.