(5E)-5-[[4-[(4-chlorophenyl)methoxy]phenyl]methylidene]-1-(4-nitrophenyl)-1,3-diazinane-2,4,6-trione

Formula:C24H16N3O6Cl Mutagenic:none Tumorigenic:none Reproductive Effective:high (5E)-5-[[4-[(4-chlorophenyl)methoxy]phenyl]methylidene]-1-(4-nitrophenyl)-1,3-diazinane-2,4,6-trione is a drug-like molecule.

MolName	(5E)-5-[[4-[(4-chlorophenyl)methoxy]phenyl]methylidene]-1-(4-nitrophenyl)-1,3-diazinane-2,4,6-trione
MolecularFormula	C24H16N3O6Cl
Smiles	[O-][N+](c(cc1)ccc1N(C(/C(/C(N1)=O)=C/c(cc2)ccc2OCc(cc2)ccc2Cl)=O)C1=O)=O
InChI	InChI=1S/C24H16ClN3O6/c25-17-5-1-16(2-6-17)14-34-20-11-3-15(4-12-20)13-21-22(29)26-24(31)27(23(21)30)18-7-9-19(10-8-18)28(32)33/h1-13H,14H2,(H,26,29,31)
InChIK	DBKLGOGRECKKFP-UHFFFAOYSA-N
TotalMolweight	477.859
Molweight	477.859
MonoisotopicMass	477.072764
CLogP	3.1879
CLogS	-6.424
H Acceptors	9
H Donors	1
TotalSurfaceArea	341.85
Relative PSA	0.27658
PolarSurfaceArea	121.53
Druglikeness	-0.42659
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	twice activated DB; aromatic nitro
Shape Index	0.61765
Fragments	1
Non HAtoms	34
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	3
Symmetricatoms	6
Amides	2
AcidicOxygens	1
StereoCon

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