TL;DR: 2-(4-Bromophenyl)-1-(3-fluorophenyl)-6-phenyl-5,6,7-trihydroindol-4-one (CAS 1024535-22-5) is a chemical compound with molecular formula C26H19BrFNO and molecular weight 459.0634 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-bromophenyl)-1-(3-fluorophenyl)-6-phenyl-6,7-dihydro-5H-indol-4-one
Also Known As: 2-(4-BROMOPHENYL)-1-(3-FLUOROPHENYL)-6-PHENYL-5,6,7-TRIHYDROINDOL-4-ONE, 2-(4-bromophenyl)-1-(3-fluorophenyl)-6-phenyl-6,7-dihydro-5H-indol-4-one, 2-(4-bromophenyl)-1-(3-fluorophenyl)-6-phenyl-4,5,6,7-tetrahydro-1H-indol-4-one, C26H19BrFNO
| Molecular Formula | C26H19BrFNO |
| Molecular Weight | 459.0634 g/mol |
| XLogP | 6.3 |
| Topological Polar Surface Area (TPSA) | 22.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 459.0634 Da |
| Heavy Atoms | 30 |
| Complexity | 600.0 |
| SMILES | C1C(CC(=O)C2=C1N(C(=C2)C3=CC=C(C=C3)Br)C4=CC(=CC=C4)F)C5=CC=CC=C5 |
| InChIKey | MDLFGIZMQMLATH-UHFFFAOYSA-N |
The XLogP value of 6.3 indicates that 2-(4-Bromophenyl)-1-(3-fluorophenyl)-6-phenyl-5,6,7-trihydroindol-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 22.0 Ų, 2-(4-Bromophenyl)-1-(3-fluorophenyl)-6-phenyl-5,6,7-trihydroindol-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Bromophenyl)-1-(3-fluorophenyl)-6-phenyl-5,6,7-trihydroindol-4-one has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 2-(4-Bromophenyl)-1-(3-fluorophenyl)-6-phenyl-5,6,7-trihydroindol-4-one is 1024535-22-5.
The molecular formula of 2-(4-Bromophenyl)-1-(3-fluorophenyl)-6-phenyl-5,6,7-trihydroindol-4-one is C26H19BrFNO.
The molecular weight of 2-(4-Bromophenyl)-1-(3-fluorophenyl)-6-phenyl-5,6,7-trihydroindol-4-one is 459.0634 g/mol.
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