TL;DR: Benzoxazole, 2,2'-o-phenylenebis- (CAS 2442-21-9) is a chemical compound with molecular formula C20H12N2O2 and molecular weight 312.08987 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[2-(1,3-benzoxazol-2-yl)phenyl]-1,3-benzoxazole
Also Known As: 2,2'- bisbenzoxazole, phenylene benzobisoxazole, 2,2'-(o-Phenylene)bisbenzoxazole, 2,2'-o-Phenylene-bis-benzoxazole, 2-[2-(1,3-benzoxazol-2-yl)phenyl]-1,3-benzoxazole
Top 5 of 11 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C20H12N2O2 |
| Molecular Weight | 312.08987 g/mol |
| XLogP | 4.9 |
| Topological Polar Surface Area (TPSA) | 52.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 312.08987 Da |
| Heavy Atoms | 24 |
| Complexity | 405.0 |
| SMILES | C1=CC=C(C(=C1)C2=NC3=CC=CC=C3O2)C4=NC5=CC=CC=C5O4 |
| InChIKey | ASDNIIDZSQLDMR-UHFFFAOYSA-N |
The XLogP value of 4.9 indicates that Benzoxazole, 2,2'-o-phenylenebis- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.1 Ų, Benzoxazole, 2,2'-o-phenylenebis- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzoxazole, 2,2'-o-phenylenebis- has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Benzoxazole, 2,2'-o-phenylenebis- is 2442-21-9.
The molecular formula of Benzoxazole, 2,2'-o-phenylenebis- is C20H12N2O2.
The molecular weight of Benzoxazole, 2,2'-o-phenylenebis- is 312.08987 g/mol.
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