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N-[3-[(E)-N-[2-(3-methoxy-4-nitropyrazol-1-yl)propanoylamino]-C-methylcarbonimidoyl]phenyl]-5-methylfuran-2-carboxamide

Also Known As: AK-968/40709130|N-[3-[(E)-N-[2-(3-methoxy-4-nitropyrazol-1-yl)propanoylamino]-C-methylcarbonimidoyl]phenyl]-5-methylfuran-2-carboxamide|N-{3-[(1E)-1-{2-[2-(3-methoxy-4-nitro-1H-pyrazol-1-yl)propanoyl]hydrazinylidene}ethyl]phenyl}-5-methylfuran-2-carboxamide|N-{3-[N-(2-{4-nitro-3-methoxy-1H-pyrazol-1-yl}propanoyl)ethanehydrazonoyl]phenyl}-5-methyl-2-furamide|N-((1E)-2-{3-[(5-methyl(2-furyl))carbonylamino]phenyl}-1-azaprop-1-enyl)-2-(3- methoxy-4-nitropyrazolyl)propanamide

Molecular Formula	C21H22N6O6
Molecular Weight	454.1601 g/mol
LogP	3.05502
Topological Polar Surface Area	153.89 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	8
Rotatable Bonds	8
Exact Mass	454.1601
Monoisotopic Mass	454.1601
Heavy Atoms	33
Complexity	1227.5681

Chemical Identifiers

CAS Number	515151-62-9
SMILES	CC1=CC=C(O1)C(=O)NC2=CC=CC(=C2)/C(=N/NC(=O)C(C)N3C=C(C(=N3)OC)[N+](=O)[O-])/C