ML 1142
3-[2-(4-chlorophenoxy)-3-[[2-(4-chlorophenoxy)-2-methylpropanoyl]amino]propanoyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid
Also Known As: ML 1142|4-Thiazolidinecarboxylic acid, 3-(3-(2-(p-chlorophenoxy)-2-methylpropionamido)-2-(p-chlorophenoxy)propionyl)-5,5-dimethyl-|3-[2-(4-chlorophenoxy)-3-[[2-(4-chlorophenoxy)-2-methylpropanoyl]amino]propanoyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid|3-[2-(4-Chlorophenoxy)-3-{[2-(4-chlorophenoxy)-1-hydroxy-2-methylpropylidene]amino}propanoyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid|4-Thiazolidinecarboxylic acid, 3-[2-(4-chlorophenoxy)-3-[[2-(4-chlorophenoxy)-2-methyl-1-oxopropyl]amino]-1-oxopropyl]-5,5-dimethyl-
| Molecular Formula | C25H28Cl2N2O6S |
|---|---|
| Molecular Weight | 554.1045 g/mol |
| LogP | 4.4793 |
| Topological Polar Surface Area | 105.17 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 554.1045 |
| Monoisotopic Mass | 554.1045 |
| Heavy Atoms | 36 |
| Complexity | 1108.5375 |
Chemical Identifiers
| CAS Number | 74007-99-1 |
|---|---|
| SMILES | CC1(C(N(CS1)C(=O)C(CNC(=O)C(C)(C)OC2=CC=C(C=C2)Cl)OC3=CC=C(C=C3)Cl)C(=O)O)C |
Product Overview
ML 1142 (CAS 74007-99-1), with molecular formula C25H28Cl2N2O6S and molecular weight 554.1045 g/mol. IUPAC: 3-[2-(4-chlorophenoxy)-3-[[2-(4-chlorophenoxy)-2-methylpropanoyl]amino]propanoyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid.
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