AC1LYP30

(5Z)-1-[(4-methoxyphenyl)methyl]-5-[(5-nitrofuran-2-yl)methylidene]-1,3-diazinane-2,4,6-trione

Also Known As: (5Z)-5-[(5-nitro-2-furyl)methylene]-1-p-anisyl-barbituric acid|1-(4-Methoxy-benzyl)-5-[1-(5-nitro-furan-2-yl)-meth-(Z)-ylidene]-pyrimidine-2,4,6-trione|(5Z)-1-[(4-methoxyphenyl)methyl]-5-[(5-nitrofuran-2-yl)methylidene]-1,3-diazinane-2,4,6-trione|(5Z)-1-(4-methoxybenzyl)-5-[(5-nitrofuran-2-yl)methylidene]pyrimidine-2,4,6(1H,3H,5H)-trione|(5Z)-1-[(4-methoxyphenyl)methyl]-5-[(5-nitro-2-furanyl)methylidene]-1,3-diazinane-2,4,6-trione|(5Z)-6-hydroxy-3-(4-methoxybenzyl)-5-[(5-nitrofuran-2-yl)methylidene]pyrimidine-2,4(3H,5H)-dione|(Z)-1-(4-methoxybenzyl)-5-((5-nitrofuran-2-yl)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione

Molecular Formula	C17H13N3O7
Molecular Weight	371.07535 g/mol
LogP	1.8584
Topological Polar Surface Area	131.99 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	7
Rotatable Bonds	5
Exact Mass	371.07535
Monoisotopic Mass	371.07535
Heavy Atoms	27
Complexity	959.16156

Chemical Identifiers

CAS Number	373374-85-7
SMILES	COC1=CC=C(C=C1)CN2C(=O)/C(=C\C3=CC=C(O3)[N+](=O)[O-])/C(=O)NC2=O