TL;DR: Ebselen Diselenide (CAS 106663-84-7) is a chemical compound with molecular formula C26H20N2O2Se2 and molecular weight 551.98553 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-phenyl-2-[[2-(phenylcarbamoyl)phenyl]diselanyl]benzamide
Also Known As: Ebselen diselenide, Bpcpds, DiEbs, 2,2-Diselenobis(N-phenylbenzamide), 2,2'-diselanediylbis(N-phenylbenzamide)
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C26H20N2O2Se2 |
| Molecular Weight | 551.98553 g/mol |
| XLogP | 3.4654 |
| Topological Polar Surface Area (TPSA) | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 551.98553 Da |
| Heavy Atoms | 32 |
| Complexity | 553.0 |
| SMILES | C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2[Se][Se]C3=CC=CC=C3C(=O)NC4=CC=CC=C4 |
| InChIKey | FTRFOFPAMKYZPH-UHFFFAOYSA-N |
The XLogP value of 3.4654 indicates that Ebselen Diselenide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.2 Ų, Ebselen Diselenide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ebselen Diselenide has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Ebselen Diselenide is 106663-84-7.
The molecular formula of Ebselen Diselenide is C26H20N2O2Se2.
The molecular weight of Ebselen Diselenide is 551.98553 g/mol.
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