TL;DR: 5,5-dimethyl-2-[4-(2-methylpropyl)phenyl]-1,3-thiazolidine-4-carboxylic Acid (CAS 1041870-96-5) is a chemical compound with molecular formula C16H23NO2S and molecular weight 293.14496 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5,5-dimethyl-2-[4-(2-methylpropyl)phenyl]-1,3-thiazolidine-4-carboxylic acid
Also Known As: 5,5-dimethyl-2-[4-(2-methylpropyl)phenyl]-1,3-thiazolidine-4-carboxylic Acid, 5,5-DIMETHYL-2-(4-(2-METHYLPROPYL)PHENYL)-1,3-THIAZOLIDINE-4-CARBOXYLIC ACID, 2-(4-isobutylphenyl)-5,5-dimethyl-thiazolidine-4-carboxylic acid, 5,5-dimethyl-2-[4-(2-methylpropyl)phenyl]-1,3-thiazolidine-4-carboxylicAcid, C16H23NO2S
| Molecular Formula | C16H23NO2S |
| Molecular Weight | 293.14496 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 293.14496 Da |
| Heavy Atoms | 20 |
| Complexity | 348.0 |
| SMILES | CC(C)CC1=CC=C(C=C1)C2NC(C(S2)(C)C)C(=O)O |
| InChIKey | MGXVWZNBFYPVBR-UHFFFAOYSA-N |
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,5-dimethyl-2-[4-(2-methylpropyl)phenyl]-1,3-thiazolidine-4-carboxylic Acid. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 5,5-dimethyl-2-[4-(2-methylpropyl)phenyl]-1,3-thiazolidine-4-carboxylic Acid. Following Lipinski's Rule of Five, 5,5-dimethyl-2-[4-(2-methylpropyl)phenyl]-1,3-thiazolidine-4-carboxylic Acid has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 5,5-dimethyl-2-[4-(2-methylpropyl)phenyl]-1,3-thiazolidine-4-carboxylic Acid is 1041870-96-5.
The molecular formula of 5,5-dimethyl-2-[4-(2-methylpropyl)phenyl]-1,3-thiazolidine-4-carboxylic Acid is C16H23NO2S.
The molecular weight of 5,5-dimethyl-2-[4-(2-methylpropyl)phenyl]-1,3-thiazolidine-4-carboxylic Acid is 293.14496 g/mol.
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