TL;DR: 2-[(E)-2-(1-benzothiophen-2-yl)ethenyl]quinoline (CAS 133610-12-5) is a chemical compound with molecular formula C19H13NS and molecular weight 287.07687 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(E)-2-(1-benzothiophen-2-yl)ethenyl]quinoline
Also Known As: BIDD:GT0334, 2-(2-(Benzo[b]thiophen-2-yl)vinyl)quinoline, 2-(2-benzothiophen-2-ylethenyl)quinoline, 2-[(E)-2-(1-benzothiophen-2-yl)ethenyl]quinoline, 2-(2-benzo(B)thiophen-2-yl-vinyl)quinoline
| Molecular Formula | C19H13NS |
| Molecular Weight | 287.07687 g/mol |
| XLogP | 5.5 |
| Topological Polar Surface Area (TPSA) | 41.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 287.07687 Da |
| Heavy Atoms | 21 |
| Complexity | 380.0 |
| SMILES | C1=CC=C2C(=C1)C=CC(=N2)/C=C/C3=CC4=CC=CC=C4S3 |
| InChIKey | BSCKHKVUCAFICJ-VAWYXSNFSA-N |
The XLogP value of 5.5 indicates that 2-[(E)-2-(1-benzothiophen-2-yl)ethenyl]quinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.1 Ų, 2-[(E)-2-(1-benzothiophen-2-yl)ethenyl]quinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(E)-2-(1-benzothiophen-2-yl)ethenyl]quinoline has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 2-[(E)-2-(1-benzothiophen-2-yl)ethenyl]quinoline is 133610-12-5.
The molecular formula of 2-[(E)-2-(1-benzothiophen-2-yl)ethenyl]quinoline is C19H13NS.
The molecular weight of 2-[(E)-2-(1-benzothiophen-2-yl)ethenyl]quinoline is 287.07687 g/mol.
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