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

Formula:C18H10N2O4ClI Mutagenic:none Tumorigenic:none Reproductive Effective:none (4Z)-2-(2-chloro-5-iodophenyl)-4-[(E)-3-(3-nitrophenyl)prop-2-enylidene]-1,3-oxazol-5-one is a drug-like molecule.

MolName	(4Z)-2-(2-chloro-5-iodophenyl)-4-[(E)-3-(3-nitrophenyl)prop-2-enylidene]-1,3-oxazol-5-one
MolecularFormula	C18H10N2O4ClI
Smiles	[O-][N+](c1cccc(/C=C/C=C2\N=C(c(cc(cc3)I)c3Cl)OC2=O)c1)=O
InChI	InChI=1S/C18H10ClIN2O4/c19-15-8-7-12(20)10-14(15)17-21-16(18(23)26-17)6-2-4-11-3-1-5-13(9-11)22(24)25/h1-10H
InChIK	XHXRPNQGBCWYGE-UHFFFAOYSA-N
TotalMolweight	480.64
Molweight	480.64
MonoisotopicMass	479.937383
CLogP	3.3699
CLogS	-6.443
H Acceptors	6
TotalSurfaceArea	286.82
Relative PSA	0.22652
PolarSurfaceArea	84.48
Druglikeness	-3.2211
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.57692
Fragments	1
Non HAtoms	26
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	4
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	2
AcidicOxygens	1
StereoCon

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