TL;DR: 3-phenyl-5-[(E)-2-phenylethenyl]-2,1-benzoxazole (CAS 1351509-06-2) is a chemical compound with molecular formula C21H15NO and molecular weight 297.11536 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-phenyl-5-[(E)-2-phenylethenyl]-2,1-benzoxazole
Also Known As: 3-Phenyl-5-styryl-benzo[c]isoxazole, 3-phenyl-5-[(E)-2-phenylethenyl]-2,1-benzoxazole, 5-((1E)-2-phenylvinyl)-3-phenylbenzo[c]isoxazole, 3-PHENYL-5-[(1E)-2-PHENYLETHENYL]-2,1-BENZOXAZOLE
| Molecular Formula | C21H15NO |
| Molecular Weight | 297.11536 g/mol |
| XLogP | 5.6 |
| Topological Polar Surface Area (TPSA) | 26.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 297.11536 Da |
| Heavy Atoms | 23 |
| Complexity | 395.0 |
| SMILES | C1=CC=C(C=C1)/C=C/C2=CC3=C(ON=C3C=C2)C4=CC=CC=C4 |
| InChIKey | PSQVKLPLTOAYNT-VAWYXSNFSA-N |
The XLogP value of 5.6 indicates that 3-phenyl-5-[(E)-2-phenylethenyl]-2,1-benzoxazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.0 Ų, 3-phenyl-5-[(E)-2-phenylethenyl]-2,1-benzoxazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-phenyl-5-[(E)-2-phenylethenyl]-2,1-benzoxazole has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 3-phenyl-5-[(E)-2-phenylethenyl]-2,1-benzoxazole is 1351509-06-2.
The molecular formula of 3-phenyl-5-[(E)-2-phenylethenyl]-2,1-benzoxazole is C21H15NO.
The molecular weight of 3-phenyl-5-[(E)-2-phenylethenyl]-2,1-benzoxazole is 297.11536 g/mol.
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