AC1NY7XN

2-[(Z)-2-[4-[(2-chlorophenyl)methoxy]-3-methoxyphenyl]ethenyl]-4-hydroxy-5-nitro-1H-pyrimidin-6-one

Also Known As: BAS 08865083|2-[(Z)-2-{4-[(2-chlorobenzyl)oxy]-3-methoxyphenyl}ethenyl]-6-hydroxy-5-nitropyrimidin-4(3H)-one|2-[(Z)-2-[4-[(2-chlorophenyl)methoxy]-3-methoxyphenyl]ethenyl]-4-hydroxy-5-nitro-1H-pyrimidin-6-one|2-[(1Z)-2-{4-[(2-chlorophenyl)methoxy]-3-methoxyphenyl}ethenyl]-6-hydroxy-5-nitro-3,4-dihydropyrimidin-4-one|2-((1Z)-2-{4-[(2-chlorophenyl)methoxy]-3-methoxyphenyl}vinyl)-6-hydroxy-5-nitr o-3-hydropyrimidin-4-one|2-[(Z)-2-[4-[(2-chlorophenyl)methoxy]-3-methoxy-phenyl]vinyl]-4-hydroxy-5-nitro-1H-pyrimidin-6-one

Molecular Formula	C20H16ClN3O6
Molecular Weight	429.07275 g/mol
LogP	3.7951
Topological Polar Surface Area	127.58 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	7
Rotatable Bonds	7
Exact Mass	429.07275
Monoisotopic Mass	429.07275
Heavy Atoms	30
Complexity	1175.4437

Chemical Identifiers

CAS Number	797779-16-9
SMILES	COC1=C(C=CC(=C1)/C=C\C2=NC(=C(C(=O)N2)[N+](=O)[O-])O)OCC3=CC=CC=C3Cl