TL;DR: 2-((4-Bromophenyl)imino)-3-(2-benzoyl-4-chlorophenyl)-4-thiazolidinone (CAS 111044-17-8) is a chemical compound with molecular formula C22H14BrClN2O2S and molecular weight 483.96478 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(2-benzoyl-4-chlorophenyl)-2-(4-bromophenyl)imino-1,3-thiazolidin-4-one
Also Known As: 2-((4-Bromophenyl)imino)-3-(2-benzoyl-4-chlorophenyl)-4-thiazolidinone, 4-Thiazolidinone, 2-((4-bromophenyl)imino)-3-(2-benzoyl-4-chlorophenyl)-, 3-(2-benzoyl-4-chlorophenyl)-2-(4-bromophenyl)imino-1,3-thiazolidin-4-one
| Molecular Formula | C22H14BrClN2O2S |
| Molecular Weight | 483.96478 g/mol |
| XLogP | 6.3 |
| Topological Polar Surface Area (TPSA) | 75.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 483.96478 Da |
| Heavy Atoms | 29 |
| Complexity | 647.0 |
| SMILES | C1C(=O)N(C(=NC2=CC=C(C=C2)Br)S1)C3=C(C=C(C=C3)Cl)C(=O)C4=CC=CC=C4 |
| InChIKey | GCXMCZNVHJIWMI-UHFFFAOYSA-N |
The XLogP value of 6.3 indicates that 2-((4-Bromophenyl)imino)-3-(2-benzoyl-4-chlorophenyl)-4-thiazolidinone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((4-Bromophenyl)imino)-3-(2-benzoyl-4-chlorophenyl)-4-thiazolidinone. Following Lipinski's Rule of Five, 2-((4-Bromophenyl)imino)-3-(2-benzoyl-4-chlorophenyl)-4-thiazolidinone has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 2-((4-Bromophenyl)imino)-3-(2-benzoyl-4-chlorophenyl)-4-thiazolidinone is 111044-17-8.
The molecular formula of 2-((4-Bromophenyl)imino)-3-(2-benzoyl-4-chlorophenyl)-4-thiazolidinone is C22H14BrClN2O2S.
The molecular weight of 2-((4-Bromophenyl)imino)-3-(2-benzoyl-4-chlorophenyl)-4-thiazolidinone is 483.96478 g/mol.
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