TL;DR: 3(2H)-Furanone, 2-(2-(4-bromophenyl)-2-oxoethylidene)-5-phenyl- (CAS 139266-50-5) is a chemical compound with molecular formula C18H11BrO3 and molecular weight 353.98917 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2E)-2-[2-(4-bromophenyl)-2-oxoethylidene]-5-phenylfuran-3-one
Also Known As: 2-(2-(4-Bromophenyl)-2-oxoethylidene)-5-phenyl-3(2H)-furanone, 3(2H)-Furanone, 2-(2-(4-bromophenyl)-2-oxoethylidene)-5-phenyl-, 2-(4-Bromobenzoylmethylene)-5-phenylfuran-3(2H)-one, (2E)-2-[2-(4-bromophenyl)-2-oxoethylidene]-5-phenylfuran-3-one, 2-[2-(4-bromophenyl)-2-oxoethylidene]-5-phenyl-2,3-dihydrofuran-3-one
| Molecular Formula | C18H11BrO3 |
| Molecular Weight | 353.98917 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 353.98917 Da |
| Heavy Atoms | 22 |
| Complexity | 506.0 |
| SMILES | C1=CC=C(C=C1)C2=CC(=O)/C(=C\C(=O)C3=CC=C(C=C3)Br)/O2 |
| InChIKey | UESQFCBFRBBRQN-VCHYOVAHSA-N |
The XLogP value of 4.0 indicates that 3(2H)-Furanone, 2-(2-(4-bromophenyl)-2-oxoethylidene)-5-phenyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.4 Ų, 3(2H)-Furanone, 2-(2-(4-bromophenyl)-2-oxoethylidene)-5-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3(2H)-Furanone, 2-(2-(4-bromophenyl)-2-oxoethylidene)-5-phenyl- has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3(2H)-Furanone, 2-(2-(4-bromophenyl)-2-oxoethylidene)-5-phenyl- is 139266-50-5.
The molecular formula of 3(2H)-Furanone, 2-(2-(4-bromophenyl)-2-oxoethylidene)-5-phenyl- is C18H11BrO3.
The molecular weight of 3(2H)-Furanone, 2-(2-(4-bromophenyl)-2-oxoethylidene)-5-phenyl- is 353.98917 g/mol.
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