TL;DR: 1-[4-[4-(2,5-Dioxopyrrolidin-1-yl)phenyl]sulfonylphenyl]pyrrolidine-2,5-dione (CAS 100546-12-1) is a chemical compound with molecular formula C20H16N2O6S and molecular weight 412.0729 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[4-[4-(2,5-dioxopyrrolidin-1-yl)phenyl]sulfonylphenyl]pyrrolidine-2,5-dione
Also Known As: Bis-(4-succinimido-phenyl)-sulfon, bis-(4-succinimido-phenyl)-sulfone, 1,1'-(sulfonyldibenzene-4,1-diyl)dipyrrolidine-2,5-dione, 1-[4-[4-(2,5-dioxopyrrolidin-1-yl)phenyl]sulfonylphenyl]pyrrolidine-2,5-dione, 1-(4-{[4-(2,5-dioxoazolidinyl)phenyl]sulfonyl}phenyl)azolidine-2,5-dione
| Molecular Formula | C20H16N2O6S |
| Molecular Weight | 412.0729 g/mol |
| XLogP | 0.3 |
| Topological Polar Surface Area (TPSA) | 117.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 412.0729 Da |
| Heavy Atoms | 29 |
| Complexity | 722.0 |
| SMILES | C1CC(=O)N(C1=O)C2=CC=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)N4C(=O)CCC4=O |
| InChIKey | OYXOSRLIYFXRRZ-UHFFFAOYSA-N |
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[4-[4-(2,5-Dioxopyrrolidin-1-yl)phenyl]sulfonylphenyl]pyrrolidine-2,5-dione. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[4-[4-(2,5-Dioxopyrrolidin-1-yl)phenyl]sulfonylphenyl]pyrrolidine-2,5-dione. Following Lipinski's Rule of Five, 1-[4-[4-(2,5-Dioxopyrrolidin-1-yl)phenyl]sulfonylphenyl]pyrrolidine-2,5-dione has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-[4-[4-(2,5-Dioxopyrrolidin-1-yl)phenyl]sulfonylphenyl]pyrrolidine-2,5-dione is 100546-12-1.
The molecular formula of 1-[4-[4-(2,5-Dioxopyrrolidin-1-yl)phenyl]sulfonylphenyl]pyrrolidine-2,5-dione is C20H16N2O6S.
The molecular weight of 1-[4-[4-(2,5-Dioxopyrrolidin-1-yl)phenyl]sulfonylphenyl]pyrrolidine-2,5-dione is 412.0729 g/mol.
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