TL;DR: 5-(2-Fluorophenyl)-1-phenyl-3-(phenylamino)-3-pyrrolin-2-one (CAS 109878-18-4) is a chemical compound with molecular formula C22H17FN2O and molecular weight 344.13248 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-anilino-2-(2-fluorophenyl)-1-phenyl-2H-pyrrol-5-one
Also Known As: DivK1c_004455, CDS1_003415, BIM-0009639.P001, AB01244833-02, 4-anilino-2-(2-fluorophenyl)-1-phenyl-2H-pyrrol-5-one
| Molecular Formula | C22H17FN2O |
| Molecular Weight | 344.13248 g/mol |
| XLogP | 4.9 |
| Topological Polar Surface Area (TPSA) | 32.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 344.13248 Da |
| Heavy Atoms | 26 |
| Complexity | 522.0 |
| SMILES | C1=CC=C(C=C1)NC2=CC(N(C2=O)C3=CC=CC=C3)C4=CC=CC=C4F |
| InChIKey | VZUHRYUJXRMROA-UHFFFAOYSA-N |
The XLogP value of 4.9 indicates that 5-(2-Fluorophenyl)-1-phenyl-3-(phenylamino)-3-pyrrolin-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.3 Ų, 5-(2-Fluorophenyl)-1-phenyl-3-(phenylamino)-3-pyrrolin-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(2-Fluorophenyl)-1-phenyl-3-(phenylamino)-3-pyrrolin-2-one has 1 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 5-(2-Fluorophenyl)-1-phenyl-3-(phenylamino)-3-pyrrolin-2-one is 109878-18-4.
The molecular formula of 5-(2-Fluorophenyl)-1-phenyl-3-(phenylamino)-3-pyrrolin-2-one is C22H17FN2O.
The molecular weight of 5-(2-Fluorophenyl)-1-phenyl-3-(phenylamino)-3-pyrrolin-2-one is 344.13248 g/mol.
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