TL;DR: 3,3'-(benzene-1,4-diyldimethanediyl)bis[5-(phenylamino)-1,3-thiazolidine-2,4-dione] (CAS 1042766-19-7) is a chemical compound with molecular formula C26H22N4O4S2 and molecular weight 518.1083 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-anilino-3-[[4-[(5-anilino-2,4-dioxo-1,3-thiazolidin-3-yl)methyl]phenyl]methyl]-1,3-thiazolidine-2,4-dione
Also Known As: 3,3'-(benzene-1,4-diyldimethanediyl)bis[5-(phenylamino)-1,3-thiazolidine-2,4-dione], 3,3'-(1,4-phenylenebis(methylene))bis(5-(phenylamino)thiazolidine-2,4-dione), 3-[(4-{[2,4-dioxo-5-(phenylamino)(1,3-thiazolidin-3-yl)]methyl}phenyl)methyl]- 5-(phenylamino)-1,3-thiazolidine-2,4-dione, 5-anilino-3-[[4-[(5-anilino-2,4-dioxo-1,3-thiazolidin-3-yl)methyl]phenyl]methyl]-1,3-thiazolidine-2,4-dione
| Molecular Formula | C26H22N4O4S2 |
| Molecular Weight | 518.1083 g/mol |
| XLogP | 5.2 |
| Topological Polar Surface Area (TPSA) | 149.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 518.1083 Da |
| Heavy Atoms | 36 |
| Complexity | 770.0 |
| SMILES | C1=CC=C(C=C1)NC2C(=O)N(C(=O)S2)CC3=CC=C(C=C3)CN4C(=O)C(SC4=O)NC5=CC=CC=C5 |
| InChIKey | FPKQKIADBHIRDF-UHFFFAOYSA-N |
The XLogP value of 5.2 indicates that 3,3'-(benzene-1,4-diyldimethanediyl)bis[5-(phenylamino)-1,3-thiazolidine-2,4-dione] is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 149.0 Ų indicates high polarity, suggesting 3,3'-(benzene-1,4-diyldimethanediyl)bis[5-(phenylamino)-1,3-thiazolidine-2,4-dione] may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3,3'-(benzene-1,4-diyldimethanediyl)bis[5-(phenylamino)-1,3-thiazolidine-2,4-dione] has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 3,3'-(benzene-1,4-diyldimethanediyl)bis[5-(phenylamino)-1,3-thiazolidine-2,4-dione] is 1042766-19-7.
The molecular formula of 3,3'-(benzene-1,4-diyldimethanediyl)bis[5-(phenylamino)-1,3-thiazolidine-2,4-dione] is C26H22N4O4S2.
The molecular weight of 3,3'-(benzene-1,4-diyldimethanediyl)bis[5-(phenylamino)-1,3-thiazolidine-2,4-dione] is 518.1083 g/mol.
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