TL;DR: (E)-3-Styrylpyridazine (CAS 128660-36-6) is a chemical compound with molecular formula C12H10N2 and molecular weight 182.0844 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[(E)-2-phenylethenyl]pyridazine
Also Known As: (E)-3-Styrylpyridazine, 3-styrylbenzoic acid, 3-(2-phenylethenyl)pyridazine, 3-[(E)-2-phenylethenyl]pyridazine, 3-(2-phenylvinyl)pyridazine
| Molecular Formula | C12H10N2 |
| Molecular Weight | 182.0844 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 25.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 182.0844 Da |
| Heavy Atoms | 14 |
| Complexity | 183.0 |
| SMILES | C1=CC=C(C=C1)/C=C/C2=NN=CC=C2 |
| InChIKey | CNYDPKJPMBRDPE-CMDGGOBGSA-N |
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-3-Styrylpyridazine. With a topological polar surface area (TPSA) of 25.8 Ų, (E)-3-Styrylpyridazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-3-Styrylpyridazine 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 (E)-3-Styrylpyridazine is 128660-36-6.
The molecular formula of (E)-3-Styrylpyridazine is C12H10N2.
The molecular weight of (E)-3-Styrylpyridazine is 182.0844 g/mol.
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