Nomifensine
TL;DR: Nomifensine (CAS 32795-47-4) is a chemical compound with molecular formula C20H22N2O4 and molecular weight 354.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-hydroxy-4-oxobut-2-enoate;2-methyl-4-phenyl-1,2,3,4-tetrahydroisoquinolin-2-ium-8-amine
Also Known As: Nomifensine, NOMIFENSINE MALEATE SALT
| Molecular Formula | C20H22N2O4 |
|---|---|
| Molecular Weight | 354.16 g/mol |
| LogP | -0.19 |
| Topological Polar Surface Area | 108.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 354.15796 |
| Heavy Atoms | 26 |
| Complexity | 402.0 |
Chemical Identifiers
| CAS Number | 32795-47-4 |
|---|---|
| SMILES | C[NH+]1CC(C2=C(C1)C(=CC=C2)N)C3=CC=CC=C3.C(=CC(=O)[O-])C(=O)O |
| InChIKey | GEOCVSMCLVIOEV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Nomifensine (CAS 32795-47-4), with molecular formula C20H22N2O4 and molecular weight 354.16 g/mol. IUPAC: 4-hydroxy-4-oxobut-2-enoate;2-methyl-4-phenyl-1,2,3,4-tetrahydroisoquinolin-2-ium-8-amine.
Chemical Property Profile of Nomifensine
Property Insights of Nomifensine
The XLogP value of -0.19 indicates that Nomifensine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Nomifensine. Following Lipinski's Rule of Five, Nomifensine has 3 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 Nomifensine?
The CAS number of Nomifensine is 32795-47-4.
What is the molecular formula of Nomifensine?
The molecular formula of Nomifensine is C20H22N2O4.
What is the molecular weight of Nomifensine?
The molecular weight of Nomifensine is 354.16 g/mol.
Where can I buy Nomifensine?
You can request a quote for Nomifensine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nomifensine?
Yes, KEHONG BIO provides custom synthesis services for Nomifensine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.