(4Z)-4-[(E)-3-(2-nitrophenyl)prop-2-enylidene]-2-phenyl-1,3-oxazol-5-one

Formula:C18H12N2O4 Mutagenic:none Tumorigenic:none Reproductive Effective:none (4Z)-4-[(E)-3-(2-nitrophenyl)prop-2-enylidene]-2-phenyl-1,3-oxazol-5-one is a drug-like molecule.

MolName	(4Z)-4-[(E)-3-(2-nitrophenyl)prop-2-enylidene]-2-phenyl-1,3-oxazol-5-one
MolecularFormula	C18H12N2O4
Smiles	[O-][N+](c1c(/C=C/C=C2\N=C(c3ccccc3)OC2=O)cccc1)=O
InChI	InChI=1S/C18H12N2O4/c21-18-15(19-17(24-18)14-8-2-1-3-9-14)11-6-10-13-7-4-5-12-16(13)20(22)23/h1-12H
InChIK	VEUIMDACLPJDDY-UHFFFAOYSA-N
TotalMolweight	320.303
Molweight	320.303
MonoisotopicMass	320.079708
CLogP	2.3268
CLogS	-4.691
H Acceptors	6
TotalSurfaceArea	245.12
Relative PSA	0.26505
PolarSurfaceArea	84.48
Druglikeness	-3.8577
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.58333
Fragments	1
Non HAtoms	24
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	4
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	2
Symmetricatoms	2
AcidicOxygens	1
StereoCon

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