(4E)-4-[[2-[(4-bromophenyl)methoxy]phenyl]methylidene]-2-(3-nitrophenyl)-1,3-oxazol-5-one

Formula:C23H15N2O5Br Mutagenic:none Tumorigenic:none Reproductive Effective:none (4E)-4-[[2-[(4-bromophenyl)methoxy]phenyl]methylidene]-2-(3-nitrophenyl)-1,3-oxazol-5-one is a drug-like molecule.

MolName	(4E)-4-[[2-[(4-bromophenyl)methoxy]phenyl]methylidene]-2-(3-nitrophenyl)-1,3-oxazol-5-one
MolecularFormula	C23H15N2O5Br
Smiles	[O-][N+](c1cccc(C(OC2=O)=N/C2=C/c(cccc2)c2OCc(cc2)ccc2Br)c1)=O
InChI	InChI=1S/C23H15BrN2O5/c24-18-10-8-15(9-11-18)14-30-21-7-2-1-4-16(21)13-20-23(27)31-22(25-20)17-5-3-6-19(12-17)26(28)29/h1-13H,14H2
InChIK	HVKGYMRACHZNFT-UHFFFAOYSA-N
TotalMolweight	479.285
Molweight	479.285
MonoisotopicMass	478.016434
CLogP	3.7435
CLogS	-6.554
H Acceptors	7
TotalSurfaceArea	320.77
Relative PSA	0.23372
PolarSurfaceArea	93.71
Druglikeness	-6.0684
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.58065
Fragments	1
Non HAtoms	31
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	4
Symmetricatoms	2
AcidicOxygens	1
StereoCon

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