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

Formula:C16H7N2O4Cl3 Mutagenic:none Tumorigenic:none Reproductive Effective:none (4Z)-2-(4-chloro-3-nitrophenyl)-4-[(2,4-dichlorophenyl)methylidene]-1,3-oxazol-5-one is a drug-like molecule.

MolName	(4Z)-2-(4-chloro-3-nitrophenyl)-4-[(2,4-dichlorophenyl)methylidene]-1,3-oxazol-5-one
MolecularFormula	C16H7N2O4Cl3
Smiles	[O-][N+](c(cc(cc1)C(OC2=O)=N/C2=C\c(ccc(Cl)c2)c2Cl)c1Cl)=O
InChI	InChI=1S/C16H7Cl3N2O4/c17-10-3-1-8(12(19)7-10)5-13-16(22)25-15(20-13)9-2-4-11(18)14(6-9)21(23)24/h1-7H
InChIK	ZDZRDISXIBPSDO-UHFFFAOYSA-N
TotalMolweight	397.601
Molweight	397.601
MonoisotopicMass	395.947139
CLogP	3.4882
CLogS	-6.587
H Acceptors	6
TotalSurfaceArea	264.88
Relative PSA	0.24528
PolarSurfaceArea	84.48
Druglikeness	-4.0702
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.56
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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