TL;DR: 2-(1-Oxo-3-phenyl-2-propen-1-yl)-1H-indene-1,3(2H)-dione (CAS 1164509-59-4) is a chemical compound with molecular formula C18H12O3 and molecular weight 276.07864 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(3-phenylprop-2-enoyl)indene-1,3-dione
Also Known As: 2-cinnamoyl-1,3-indandione, 2-Cinnamoyl-1H-indene-1,3(2H)-dione, 2-(3-PHENYL-ACRYLOYL)-INDAN-1,3-DIONE, 2-(3-phenylprop-2-enoyl)indane-1,3-dione, 2-(3-phenylprop-2-enoyl)indene-1,3-dione
| Molecular Formula | C18H12O3 |
| Molecular Weight | 276.07864 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 51.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 276.07864 Da |
| Heavy Atoms | 21 |
| Complexity | 447.0 |
| SMILES | C1=CC=C(C=C1)C=CC(=O)C2C(=O)C3=CC=CC=C3C2=O |
| InChIKey | YXFGAICZGGUTCL-UHFFFAOYSA-N |
The XLogP value of 3.2 indicates that 2-(1-Oxo-3-phenyl-2-propen-1-yl)-1H-indene-1,3(2H)-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.2 Ų, 2-(1-Oxo-3-phenyl-2-propen-1-yl)-1H-indene-1,3(2H)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1-Oxo-3-phenyl-2-propen-1-yl)-1H-indene-1,3(2H)-dione 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 2-(1-Oxo-3-phenyl-2-propen-1-yl)-1H-indene-1,3(2H)-dione is 1164509-59-4.
The molecular formula of 2-(1-Oxo-3-phenyl-2-propen-1-yl)-1H-indene-1,3(2H)-dione is C18H12O3.
The molecular weight of 2-(1-Oxo-3-phenyl-2-propen-1-yl)-1H-indene-1,3(2H)-dione is 276.07864 g/mol.
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