TL;DR: 2-(4-bromo-1-methyl-1H-pyrazol-5-yl)-1,3-thiazolidine-4-carboxylic acid (CAS 1044257-86-4) is a chemical compound with molecular formula C8H10BrN3O2S and molecular weight 290.9677 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-bromo-1-methylpyrazol-5-yl)-1,3-thiazolidine-4-carboxylic acid
Also Known As: 2-(4-Bromo-1-methyl-1H-pyrazol-5-yl)thiazolidine-4-carboxylic acid, 2-(4-bromo-1-methyl-1H-pyrazol-5-yl)-1,3-thiazolidine-4-carboxylic acid, 2-(4-bromo-2-methyl-pyrazol-3-yl)-1,3-thiazolidine-4-carboxylic Acid, 2-(4-bromo-2-methylpyrazol-3-yl)-1,3-thiazolidine-4-carboxylic acid, 2-(4-BROMO-1-METHYL-1H-PYRAZOL-5-YL)-1,3-THIAZOLANE-4-CARBOXYLIC ACID
| Molecular Formula | C8H10BrN3O2S |
| Molecular Weight | 290.9677 g/mol |
| XLogP | -1.8 |
| Topological Polar Surface Area (TPSA) | 92.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 290.9677 Da |
| Heavy Atoms | 15 |
| Complexity | 268.0 |
| SMILES | CN1C(=C(C=N1)Br)C2NC(CS2)C(=O)O |
| InChIKey | LTVOQAMEINQNNA-UHFFFAOYSA-N |
The XLogP value of -1.8 indicates that 2-(4-bromo-1-methyl-1H-pyrazol-5-yl)-1,3-thiazolidine-4-carboxylic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 92.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-bromo-1-methyl-1H-pyrazol-5-yl)-1,3-thiazolidine-4-carboxylic acid. Following Lipinski's Rule of Five, 2-(4-bromo-1-methyl-1H-pyrazol-5-yl)-1,3-thiazolidine-4-carboxylic acid has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-(4-bromo-1-methyl-1H-pyrazol-5-yl)-1,3-thiazolidine-4-carboxylic acid is 1044257-86-4.
The molecular formula of 2-(4-bromo-1-methyl-1H-pyrazol-5-yl)-1,3-thiazolidine-4-carboxylic acid is C8H10BrN3O2S.
The molecular weight of 2-(4-bromo-1-methyl-1H-pyrazol-5-yl)-1,3-thiazolidine-4-carboxylic acid is 290.9677 g/mol.
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