TL;DR: 3-(4-Bromobenzyl)-1,3-thiazolidine-2,4-dione (CAS 163777-88-6) is a chemical compound with molecular formula C10H8BrNO2S and molecular weight 284.94592 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[(4-bromophenyl)methyl]-1,3-thiazolidine-2,4-dione
Also Known As: 3-(4-bromobenzyl)-1,3-thiazolidine-2,4-dione, 3-[(4-bromophenyl)methyl]-1,3-thiazolidine-2,4-dione, 3-(4-bromobenzyl)thiazolidine-2,4-dione, 3-(4-bromobenzyl)-thiazolidine-2,4-dione
| Molecular Formula | C10H8BrNO2S |
| Molecular Weight | 284.94592 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 62.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 284.94592 Da |
| Heavy Atoms | 15 |
| Complexity | 277.0 |
| SMILES | C1C(=O)N(C(=O)S1)CC2=CC=C(C=C2)Br |
| InChIKey | MHKWWBFAZJSLGX-UHFFFAOYSA-N |
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-Bromobenzyl)-1,3-thiazolidine-2,4-dione. The TPSA of 62.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-Bromobenzyl)-1,3-thiazolidine-2,4-dione. Following Lipinski's Rule of Five, 3-(4-Bromobenzyl)-1,3-thiazolidine-2,4-dione has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3-(4-Bromobenzyl)-1,3-thiazolidine-2,4-dione is 163777-88-6.
The molecular formula of 3-(4-Bromobenzyl)-1,3-thiazolidine-2,4-dione is C10H8BrNO2S.
The molecular weight of 3-(4-Bromobenzyl)-1,3-thiazolidine-2,4-dione is 284.94592 g/mol.
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