2-[(E)-2-(1-benzyl-1H-indol-3-yl)ethenyl]-6-hydroxy-5-nitropyrimidin-4(3H)-one

2-[(E)-2-(1-benzylindol-3-yl)ethenyl]-4-hydroxy-5-nitro-1H-pyrimidin-6-one

Also Known As: BAS 08882471|2-[(E)-2-(1-benzyl-1H-indol-3-yl)ethenyl]-6-hydroxy-5-nitropyrimidin-4(3H)-one|2-[(E)-2-(1-benzyl-1H-indol-3-yl)ethenyl]-5-nitropyrimidine-4,6-diol|(E)-2-(2-(1-benzyl-1H-indol-3-yl)vinyl)-6-hydroxy-5-nitropyrimidin-4(3H)-one|2-[(E)-2-(1-Benzyl-1H-indol-3-yl)-vinyl]-6-hydroxy-5-nitro-3H-pyrimidin-4-one|2-[(E)-2-(1-benzylindol-3-yl)ethenyl]-4-hydroxy-5-nitro-1H-pyrimidin-6-one|2-[2-(1-benzyl-1H-indol-3-yl)vinyl]-6-hydroxy-5-nitro-4(3H)-pyrimidinone|2-{(1E)-2-[1-benzylindol-3-yl]vinyl}-6-hydroxy-5-nitro-3-hydropyrimidin-4-one

Molecular Formula	C21H16N4O4
Molecular Weight	388.11716 g/mol
LogP	3.5571
Topological Polar Surface Area	114.05 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	5
Rotatable Bonds	5
Exact Mass	388.11716
Monoisotopic Mass	388.11716
Heavy Atoms	29
Complexity	1289.2826

Chemical Identifiers

CAS Number	797779-64-7
SMILES	C1=CC=C(C=C1)CN2C=C(C3=CC=CC=C32)/C=C/C4=NC(=C(C(=O)N4)[N+](=O)[O-])O