N-benzylquinolin-3-amine
TL;DR: N-benzylquinolin-3-amine (CAS 23976-28-5) is a chemical compound with molecular formula C16H14N2 and molecular weight 234.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzylquinolin-3-amine
Also Known As: N-benzylquinolin-3-amine, BENZYLAMINE DERIVITIVE, 3-Quinolinamine, N-(phenylmethyl)-
| Molecular Formula | C16H14N2 |
|---|---|
| Molecular Weight | 234.12 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 24.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 234.11569 |
| Heavy Atoms | 18 |
| Complexity | 247.0 |
Chemical Identifiers
| CAS Number | 23976-28-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNC2=CC3=CC=CC=C3N=C2 |
| InChIKey | WFLLCYYTXLDQAN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-benzylquinolin-3-amine (CAS 23976-28-5), with molecular formula C16H14N2 and molecular weight 234.12 g/mol. IUPAC: N-benzylquinolin-3-amine.
Chemical Property Profile of N-benzylquinolin-3-amine
Property Insights of N-benzylquinolin-3-amine
The XLogP value of 4.0 indicates that N-benzylquinolin-3-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.9 Ų, N-benzylquinolin-3-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-benzylquinolin-3-amine has 1 hydrogen bond donor(s) and 2 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-benzylquinolin-3-amine?
The CAS number of N-benzylquinolin-3-amine is 23976-28-5.
What is the molecular formula of N-benzylquinolin-3-amine?
The molecular formula of N-benzylquinolin-3-amine is C16H14N2.
What is the molecular weight of N-benzylquinolin-3-amine?
The molecular weight of N-benzylquinolin-3-amine is 234.12 g/mol.
Where can I buy N-benzylquinolin-3-amine?
You can request a quote for N-benzylquinolin-3-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-benzylquinolin-3-amine?
Yes, KEHONG BIO provides custom synthesis services for N-benzylquinolin-3-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.