AC1LUTO8

(5E)-5-[[1-[2-(2,4-dimethylphenoxy)ethyl]pyrrol-2-yl]methylidene]-1-(4-ethylphenyl)-1,3-diazinane-2,4,6-trione

Also Known As: (5E)-5-({1-[2-(2,4-dimethylphenoxy)ethyl]-1H-pyrrol-2-yl}methylidene)-1-(4-ethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione|(E)-5-((1-(2-(2,4-dimethylphenoxy)ethyl)-1H-pyrrol-2-yl)methylene)-1-(4-ethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione|(5E)-5-({1-[2-(2,4-dimethylphenoxy)ethyl]-1H-pyrrol-2-yl}methylidene)-3-(4-ethylphenyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione|(5E)-5-[[1-[2-(2,4-dimethylphenoxy)ethyl]pyrrol-2-yl]methylidene]-1-(4-ethylphenyl)-1,3-diazinane-2,4,6-trione

Molecular Formula	C27H27N3O4
Molecular Weight	457.20016 g/mol
LogP	4.41274
Topological Polar Surface Area	80.64 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	4
Rotatable Bonds	7
Exact Mass	457.20016
Monoisotopic Mass	457.20016
Heavy Atoms	34
Complexity	1271.2822

Chemical Identifiers

CAS Number	672944-89-7
SMILES	CCC1=CC=C(C=C1)N2C(=O)/C(=C/C3=CC=CN3CCOC4=C(C=C(C=C4)C)C)/C(=O)NC2=O