TL;DR: 4-Thiazolidinone,5-(phenylmethylene)-3-[[[4-(1-piperidinylcarbonyl)phenyl]amino]methyl]-2-thioxo- (CAS 104183-46-2) is a chemical compound with molecular formula C23H23N3O2S2 and molecular weight 437.12317 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-benzylidene-3-[[4-(piperidine-1-carbonyl)anilino]methyl]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: 4-Thiazolidinone,5-(phenylmethylene)-3-[[[4-(1-piperidinylcarbonyl)phenyl]amino]methyl]-2-thioxo-, 1-(4-(((4-Oxo-5-(phenylmethylene)-2-thioxo-3-thiazolidinyl)methyl)amino)benzoyl)piperidine, Piperidine, 1-(4-(((4-oxo-5-(phenylmethylene)-2-thioxo-3-thiazolidinyl)methyl)amino)benzoyl)-
| Molecular Formula | C23H23N3O2S2 |
| Molecular Weight | 437.12317 g/mol |
| XLogP | 5.1 |
| Topological Polar Surface Area (TPSA) | 110.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 437.12317 Da |
| Heavy Atoms | 30 |
| Complexity | 676.0 |
| SMILES | C1CCN(CC1)C(=O)C2=CC=C(C=C2)NCN3C(=O)C(=CC4=CC=CC=C4)SC3=S |
| InChIKey | RDXHMUSCWAXAOY-UHFFFAOYSA-N |
The XLogP value of 5.1 indicates that 4-Thiazolidinone,5-(phenylmethylene)-3-[[[4-(1-piperidinylcarbonyl)phenyl]amino]methyl]-2-thioxo- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Thiazolidinone,5-(phenylmethylene)-3-[[[4-(1-piperidinylcarbonyl)phenyl]amino]methyl]-2-thioxo-. Following Lipinski's Rule of Five, 4-Thiazolidinone,5-(phenylmethylene)-3-[[[4-(1-piperidinylcarbonyl)phenyl]amino]methyl]-2-thioxo- has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 4-Thiazolidinone,5-(phenylmethylene)-3-[[[4-(1-piperidinylcarbonyl)phenyl]amino]methyl]-2-thioxo- is 104183-46-2.
The molecular formula of 4-Thiazolidinone,5-(phenylmethylene)-3-[[[4-(1-piperidinylcarbonyl)phenyl]amino]methyl]-2-thioxo- is C23H23N3O2S2.
The molecular weight of 4-Thiazolidinone,5-(phenylmethylene)-3-[[[4-(1-piperidinylcarbonyl)phenyl]amino]methyl]-2-thioxo- is 437.12317 g/mol.
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