AC1LYOEK
N-[(E)-3-(azepan-1-yl)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-tert-butylbenzamide
Also Known As: (E)-N-(3-(azepan-1-yl)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl)-4-(tert-butyl)benzamide|N-[(1E)-3-(azepan-1-yl)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-tert-butylbenzamide|N-[(E)-3-(azepan-1-yl)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-tert-butylbenzamide|N-[3-(azepan-1-yl)-1-(3-nitrophenyl)-3-oxo-prop-1-en-2-yl]-4-tert-butyl-benzamide
CAS: 373376-48-8
| Molecular Formula | C26H31N3O4 |
|---|---|
| Molecular Weight | 449.23145 g/mol |
| LogP | 5.0658 |
| Topological Polar Surface Area | 92.55 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 449.23145 |
| Monoisotopic Mass | 449.23145 |
| Heavy Atoms | 33 |
| Complexity | 1043.9518 |
Chemical Identifiers
| CAS Number | 373376-48-8 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C(=O)N/C(=C/C2=CC(=CC=C2)[N+](=O)[O-])/C(=O)N3CCCCCC3 |
Product Overview
AC1LYOEK (CAS 373376-48-8), with molecular formula C26H31N3O4 and molecular weight 449.23145 g/mol. IUPAC: N-[(E)-3-(azepan-1-yl)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-tert-butylbenzamide.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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