(4Z)-4-[(5-bromo-2-fluorophenyl)methylidene]-2-(4-chloro-3-nitrophenyl)-1,3-oxazol-5-one

Formula:C16H7N2O4BrClF Mutagenic:none Tumorigenic:none Reproductive Effective:none (4Z)-4-[(5-bromo-2-fluorophenyl)methylidene]-2-(4-chloro-3-nitrophenyl)-1,3-oxazol-5-one is a drug-like molecule.

MolName	(4Z)-4-[(5-bromo-2-fluorophenyl)methylidene]-2-(4-chloro-3-nitrophenyl)-1,3-oxazol-5-one
MolecularFormula	C16H7N2O4BrClF
Smiles	[O-][N+](c(cc(cc1)C(OC2=O)=N/C2=C\c(cc(cc2)Br)c2F)c1Cl)=O
InChI	InChI=1S/C16H7BrClFN2O4/c17-10-2-4-12(19)9(5-10)6-13-16(22)25-15(20-13)8-1-3-11(18)14(7-8)21(23)24/h1-7H
InChIK	AHGPMIZNYJZQOU-UHFFFAOYSA-N
TotalMolweight	425.597
Molweight	425.597
MonoisotopicMass	423.926174
CLogP	3.1022
CLogS	-6.263
H Acceptors	6
TotalSurfaceArea	259.02
Relative PSA	0.25083
PolarSurfaceArea	84.48
Druglikeness	-7.2002
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.52
Fragments	1
Non HAtoms	25
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	3
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	2
AcidicOxygens	1
StereoCon

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