TL;DR: Benzoic acid, 4-(2-(4-(5-methyl-2-benzoxazolyl)phenyl)ethenyl)- (CAS 61257-43-0) is a chemical compound with molecular formula C23H17NO3 and molecular weight 355.12085 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[2-[4-(5-methyl-1,3-benzoxazol-2-yl)phenyl]ethenyl]benzoic acid
Also Known As: 4'-(5-Methylbenzoxazol-2-yl)stilbene-4-carboxylic acid, Benzoic acid, 4-(2-(4-(5-methyl-2-benzoxazolyl)phenyl)ethenyl)-, Benzoic acid, 4-[2-[4-(5-methyl-2-benzoxazolyl)phenyl]ethenyl]-, p-(o-(4-(5-Methylbenzoxazol-2-yl)phenyl)vinyl)benzoic acid, P-[o-[4-(5-methylbenzoxazol-2-yl)phenyl]vinyl]benzoic acid
| Molecular Formula | C23H17NO3 |
| Molecular Weight | 355.12085 g/mol |
| XLogP | 5.6 |
| Topological Polar Surface Area (TPSA) | 63.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 355.12085 Da |
| Heavy Atoms | 27 |
| Complexity | 532.0 |
| SMILES | CC1=CC2=C(C=C1)OC(=N2)C3=CC=C(C=C3)C=CC4=CC=C(C=C4)C(=O)O |
| InChIKey | FFTHGPXRVMFOIC-UHFFFAOYSA-N |
The XLogP value of 5.6 indicates that Benzoic acid, 4-(2-(4-(5-methyl-2-benzoxazolyl)phenyl)ethenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 4-(2-(4-(5-methyl-2-benzoxazolyl)phenyl)ethenyl)-. Following Lipinski's Rule of Five, Benzoic acid, 4-(2-(4-(5-methyl-2-benzoxazolyl)phenyl)ethenyl)- has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Benzoic acid, 4-(2-(4-(5-methyl-2-benzoxazolyl)phenyl)ethenyl)- is 61257-43-0.
The molecular formula of Benzoic acid, 4-(2-(4-(5-methyl-2-benzoxazolyl)phenyl)ethenyl)- is C23H17NO3.
The molecular weight of Benzoic acid, 4-(2-(4-(5-methyl-2-benzoxazolyl)phenyl)ethenyl)- is 355.12085 g/mol.
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