AC1NNI1T
propyl 4-(4-tert-butylphenyl)-2-[2-(2,5-dichlorophenoxy)butanoylamino]-5-methylthiophene-3-carboxylate
Also Known As: AK-968/41018061|propyl 4-(4-tert-butylphenyl)-2-[2-(2,5-dichlorophenoxy)butanoylamino]-5-methylthiophene-3-carboxylate|propyl 4-(4-tert-butylphenyl)-2-{[2-(2,5-dichlorophenoxy)butanoyl]amino}-5-methyl-3-thiophenecarboxylate|propyl 4-(4-tert-butylphenyl)-2-{[2-(2,5-dichlorophenoxy)butanoyl]amino}-5-methylthiophene-3-carboxylate|propyl 2-[2-(2,5-dichlorophenoxy)butanoylamino]-4-[4-(tert-butyl)phenyl]-5-met hylthiophene-3-carboxylate|propyl 4-(4-(tert-butyl)phenyl)-2-(2-(2,5-dichlorophenoxy)butanamido)-5-methylthiophene-3-carboxylate
| Molecular Formula | C29H33Cl2NO4S |
|---|---|
| Molecular Weight | 561.15076 g/mol |
| LogP | 8.69072 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 561.15076 |
| Monoisotopic Mass | 561.15076 |
| Heavy Atoms | 37 |
| Complexity | 1262.1464 |
Chemical Identifiers
| CAS Number | 438199-03-2 |
|---|---|
| SMILES | CCCOC(=O)C1=C(SC(=C1C2=CC=C(C=C2)C(C)(C)C)C)NC(=O)C(CC)OC3=C(C=CC(=C3)Cl)Cl |
Product Overview
AC1NNI1T (CAS 438199-03-2), with molecular formula C29H33Cl2NO4S and molecular weight 561.15076 g/mol. IUPAC: propyl 4-(4-tert-butylphenyl)-2-[2-(2,5-dichlorophenoxy)butanoylamino]-5-methylthiophene-3-carboxylate.
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