TL;DR: (E)-(5-(furan-2-yl)isoxazol-3-yl)methyl 3-(thiophen-2-yl)acrylate (CAS 1212794-66-5) is a chemical compound with molecular formula C15H11NO4S and molecular weight 301.0409 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl (E)-3-thiophen-2-ylprop-2-enoate
Also Known As: F2496-3211, (E)-(5-(furan-2-yl)isoxazol-3-yl)methyl 3-(thiophen-2-yl)acrylate, [5-(furan-2-yl)-1,2-oxazol-3-yl]methyl (E)-3-thiophen-2-ylprop-2-enoate
| Molecular Formula | C15H11NO4S |
| Molecular Weight | 301.0409 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 93.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 301.0409 Da |
| Heavy Atoms | 21 |
| Complexity | 390.0 |
| SMILES | C1=COC(=C1)C2=CC(=NO2)COC(=O)/C=C/C3=CC=CS3 |
| InChIKey | LEWPVBRGEVBTNE-AATRIKPKSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-(5-(furan-2-yl)isoxazol-3-yl)methyl 3-(thiophen-2-yl)acrylate. The TPSA of 93.7 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-(5-(furan-2-yl)isoxazol-3-yl)methyl 3-(thiophen-2-yl)acrylate. Following Lipinski's Rule of Five, (E)-(5-(furan-2-yl)isoxazol-3-yl)methyl 3-(thiophen-2-yl)acrylate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (E)-(5-(furan-2-yl)isoxazol-3-yl)methyl 3-(thiophen-2-yl)acrylate is 1212794-66-5.
The molecular formula of (E)-(5-(furan-2-yl)isoxazol-3-yl)methyl 3-(thiophen-2-yl)acrylate is C15H11NO4S.
The molecular weight of (E)-(5-(furan-2-yl)isoxazol-3-yl)methyl 3-(thiophen-2-yl)acrylate is 301.0409 g/mol.
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