TL;DR: 3-((4-Ethylphenyl)amino)-1-phenylpyrrolidine-2,5-dione (CAS 1008061-39-9) is a chemical compound with molecular formula C18H18N2O2 and molecular weight 294.13684 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(4-ethylanilino)-1-phenylpyrrolidine-2,5-dione
Also Known As: 3-(4-ethylanilino)-1-phenylpyrrolidine-2,5-dione, 3-((4-ethylphenyl)amino)-1-phenylpyrrolidine-2,5-dione, 3-[(4-ethylphenyl)amino]-1-phenylpyrrolidine-2,5-dione, F3023-0379, 3-[(4-ethylphenyl)amino]-1-phenylazolidine-2,5-dione
| Molecular Formula | C18H18N2O2 |
| Molecular Weight | 294.13684 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 49.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 294.13684 Da |
| Heavy Atoms | 22 |
| Complexity | 409.0 |
| SMILES | CCC1=CC=C(C=C1)NC2CC(=O)N(C2=O)C3=CC=CC=C3 |
| InChIKey | VCLABCPKVAUGLP-UHFFFAOYSA-N |
The XLogP value of 3.3 indicates that 3-((4-Ethylphenyl)amino)-1-phenylpyrrolidine-2,5-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.4 Ų, 3-((4-Ethylphenyl)amino)-1-phenylpyrrolidine-2,5-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-((4-Ethylphenyl)amino)-1-phenylpyrrolidine-2,5-dione 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 3-((4-Ethylphenyl)amino)-1-phenylpyrrolidine-2,5-dione is 1008061-39-9.
The molecular formula of 3-((4-Ethylphenyl)amino)-1-phenylpyrrolidine-2,5-dione is C18H18N2O2.
The molecular weight of 3-((4-Ethylphenyl)amino)-1-phenylpyrrolidine-2,5-dione is 294.13684 g/mol.
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