Vadocaine
TL;DR: Vadocaine (CAS 72005-58-4) is a chemical compound with molecular formula C18H28N2O2 and molecular weight 304.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-methoxy-4,6-dimethylphenyl)-3-(2-methylpiperidin-1-yl)propanamide
Also Known As: Vadocaine, Vadocaina, Vadocainum, Vadocaine [INN], Vadocainum [Latin]
| Molecular Formula | C18H28N2O2 |
|---|---|
| Molecular Weight | 304.22 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 41.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 304.2151 |
| Heavy Atoms | 22 |
| Complexity | 361.0 |
Chemical Identifiers
| CAS Number | 72005-58-4 |
|---|---|
| SMILES | CC1CCCCN1CCC(=O)NC2=C(C=C(C=C2OC)C)C |
| InChIKey | UJCARUGFZOJPMI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Vadocaine (CAS 72005-58-4), with molecular formula C18H28N2O2 and molecular weight 304.22 g/mol. IUPAC: N-(2-methoxy-4,6-dimethylphenyl)-3-(2-methylpiperidin-1-yl)propanamide.
Chemical Property Profile of Vadocaine
Property Insights of Vadocaine
The XLogP value of 3.0 indicates that Vadocaine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.6 Ų, Vadocaine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Vadocaine has 1 hydrogen bond donor(s) and 3 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 Vadocaine?
The CAS number of Vadocaine is 72005-58-4.
What is the molecular formula of Vadocaine?
The molecular formula of Vadocaine is C18H28N2O2.
What is the molecular weight of Vadocaine?
The molecular weight of Vadocaine is 304.22 g/mol.
Where can I buy Vadocaine?
You can request a quote for Vadocaine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Vadocaine?
Yes, KEHONG BIO provides custom synthesis services for Vadocaine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.