TL;DR: 3-(Benzylamino)-1-(4-fluorophenyl)pyrrolidine-2,5-dione (CAS 1008648-37-0) is a chemical compound with molecular formula C17H15FN2O2 and molecular weight 298.11176 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(benzylamino)-1-(4-fluorophenyl)pyrrolidine-2,5-dione
Also Known As: 3-(benzylamino)-1-(4-fluorophenyl)pyrrolidine-2,5-dione, 3-(benzylamino)-1-(4-fluorophenyl)-2,5-pyrrolidinedione
| Molecular Formula | C17H15FN2O2 |
| Molecular Weight | 298.11176 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 49.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 298.11176 Da |
| Heavy Atoms | 22 |
| Complexity | 415.0 |
| SMILES | C1C(C(=O)N(C1=O)C2=CC=C(C=C2)F)NCC3=CC=CC=C3 |
| InChIKey | SVRYXSWIEUXJCO-UHFFFAOYSA-N |
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Benzylamino)-1-(4-fluorophenyl)pyrrolidine-2,5-dione. With a topological polar surface area (TPSA) of 49.4 Ų, 3-(Benzylamino)-1-(4-fluorophenyl)pyrrolidine-2,5-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Benzylamino)-1-(4-fluorophenyl)pyrrolidine-2,5-dione has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3-(Benzylamino)-1-(4-fluorophenyl)pyrrolidine-2,5-dione is 1008648-37-0.
The molecular formula of 3-(Benzylamino)-1-(4-fluorophenyl)pyrrolidine-2,5-dione is C17H15FN2O2.
The molecular weight of 3-(Benzylamino)-1-(4-fluorophenyl)pyrrolidine-2,5-dione is 298.11176 g/mol.
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