TL;DR: 4-(4-fluorophenyl)-1-(4-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one (CAS 115653-72-0) is a chemical compound with molecular formula C17H14FNO2 and molecular weight 283.10086 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(4-fluorophenyl)-1-(4-methoxyphenyl)-2H-pyrrol-5-one
Also Known As: Bionet2_000845, 3-(4-fluorophenyl)-1-(4-methoxyphenyl)-2H-pyrrol-5-one, 4-(4-fluorophenyl)-1-(4-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one, 6H-032, 4-(4-fluorophenyl)-1-(4-methoxyphenyl)-2,5-dihydro-1H-pyrrol-2-one
| Molecular Formula | C17H14FNO2 |
| Molecular Weight | 283.10086 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 283.10086 Da |
| Heavy Atoms | 21 |
| Complexity | 407.0 |
| SMILES | COC1=CC=C(C=C1)N2CC(=CC2=O)C3=CC=C(C=C3)F |
| InChIKey | DRDDVACKIADGDI-UHFFFAOYSA-N |
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(4-fluorophenyl)-1-(4-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one. With a topological polar surface area (TPSA) of 29.5 Ų, 4-(4-fluorophenyl)-1-(4-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4-fluorophenyl)-1-(4-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one 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 4-(4-fluorophenyl)-1-(4-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one is 115653-72-0.
The molecular formula of 4-(4-fluorophenyl)-1-(4-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one is C17H14FNO2.
The molecular weight of 4-(4-fluorophenyl)-1-(4-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one is 283.10086 g/mol.
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