TL;DR: Vinylpyrazine (CAS 4177-16-6) is a chemical compound with molecular formula C6H6N2 and molecular weight 106.0531 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-ethenylpyrazine
Also Known As: 2-Vinylpyrazine, Vinylpyrazine, 2-ethenylpyrazine, Pyrazine, ethenyl-, ethenylpyrazine
Top 5 of 19 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C6H6N2 |
| Molecular Weight | 106.0531 g/mol |
| XLogP | 0.6 |
| Topological Polar Surface Area (TPSA) | 25.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 106.0531 Da |
| Heavy Atoms | 8 |
| Complexity | 80.0 |
| SMILES | C=CC1=NC=CN=C1 |
| InChIKey | KANZWHBYRHQMKZ-UHFFFAOYSA-N |
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Vinylpyrazine. With a topological polar surface area (TPSA) of 25.8 Ų, Vinylpyrazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Vinylpyrazine 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 Vinylpyrazine is 4177-16-6.
The molecular formula of Vinylpyrazine is C6H6N2.
The molecular weight of Vinylpyrazine is 106.0531 g/mol.
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