AC1N6LHE
4-butyl-N-[2-(4-nitrophenyl)-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]cyclohexane-1-carboxamide
Also Known As: Oprea1_322498|SR-01000570295-1|F0541-0600|4-butyl-N-(2-(4-nitrophenyl)-5,5-dioxido-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)cyclohexanecarboxamide|4-butyl-N-[2-(4-nitrophenyl)-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]cyclohexane-1-carboxamide|4-butyl-N-[2-(4-nitrophenyl)-5,5-dioxido-2,6-dihydro-4H-thieno[3,4-c]pyrazol-3-yl]cyclohexanecarboxamide
| Molecular Formula | C22H28N4O5S |
|---|---|
| Molecular Weight | 460.17804 g/mol |
| LogP | 4.144 |
| Topological Polar Surface Area | 124.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 460.17804 |
| Monoisotopic Mass | 460.17804 |
| Heavy Atoms | 32 |
| Complexity | 1115.935 |
Chemical Identifiers
| CAS Number | 449792-50-1 |
|---|---|
| SMILES | CCCCC1CCC(CC1)C(=O)NC2=C3CS(=O)(=O)CC3=NN2C4=CC=C(C=C4)[N+](=O)[O-] |
Product Overview
AC1N6LHE (CAS 449792-50-1), with molecular formula C22H28N4O5S and molecular weight 460.17804 g/mol. IUPAC: 4-butyl-N-[2-(4-nitrophenyl)-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]cyclohexane-1-carboxamide.
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