AC1MH9IL
2-(1-adamantyl)-N-[[4-(4-butanoylpiperazin-1-yl)-3-chlorophenyl]carbamothioyl]acetamide
Also Known As: 2-(1-adamantyl)-N-[[4-(4-butanoylpiperazin-1-yl)-3-chlorophenyl]carbamothioyl]acetamide|2-(1-adamantyl)-N-[[4-(4-butanoylpiperazin-1-yl)-3-chloro-phenyl]thiocarbamoyl]acetamide|2-((3r,5r,7r)-adamantan-1-yl)-N-((4-(4-butyrylpiperazin-1-yl)-3-chlorophenyl)carbamothioyl)acetamide|N-{[4-(4-butanoylpiperazin-1-yl)-3-chlorophenyl]carbamothioyl}-2-(tricyclo[3.3.1.1~3,7~]dec-1-yl)acetamide
| Molecular Formula | C27H37ClN4O2S |
|---|---|
| Molecular Weight | 516.2326 g/mol |
| LogP | 5.2082 |
| Topological Polar Surface Area | 64.68 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 516.2326 |
| Monoisotopic Mass | 516.2326 |
| Heavy Atoms | 35 |
| Complexity | 956.1092 |
Chemical Identifiers
| CAS Number | 593239-91-9 |
|---|---|
| SMILES | CCCC(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=S)NC(=O)CC34CC5CC(C3)CC(C5)C4)Cl |
Product Overview
AC1MH9IL (CAS 593239-91-9), with molecular formula C27H37ClN4O2S and molecular weight 516.2326 g/mol. IUPAC: 2-(1-adamantyl)-N-[[4-(4-butanoylpiperazin-1-yl)-3-chlorophenyl]carbamothioyl]acetamide.
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