TL;DR: 4-(2-isoquinolin-1-ylethenyl)-N,N-dimethylaniline (CAS 110146-02-6) is a chemical compound with molecular formula C19H18N2 and molecular weight 274.147 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(2-isoquinolin-1-ylethenyl)-N,N-dimethylaniline
Also Known As: 4-[2-(1-isoquinolinyl)vinyl]-N,N-dimethylaniline, 4-(2-isoquinolin-1-ylethenyl)-N,N-dimethylaniline
| Molecular Formula | C19H18N2 |
| Molecular Weight | 274.147 g/mol |
| XLogP | 4.5 |
| Topological Polar Surface Area (TPSA) | 16.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 274.147 Da |
| Heavy Atoms | 21 |
| Complexity | 341.0 |
| SMILES | CN(C)C1=CC=C(C=C1)C=CC2=NC=CC3=CC=CC=C32 |
| InChIKey | SZIQJAQQBGULIE-UHFFFAOYSA-N |
The XLogP value of 4.5 indicates that 4-(2-isoquinolin-1-ylethenyl)-N,N-dimethylaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 16.1 Ų, 4-(2-isoquinolin-1-ylethenyl)-N,N-dimethylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(2-isoquinolin-1-ylethenyl)-N,N-dimethylaniline has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-(2-isoquinolin-1-ylethenyl)-N,N-dimethylaniline is 110146-02-6.
The molecular formula of 4-(2-isoquinolin-1-ylethenyl)-N,N-dimethylaniline is C19H18N2.
The molecular weight of 4-(2-isoquinolin-1-ylethenyl)-N,N-dimethylaniline is 274.147 g/mol.
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