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

Formula:C23H15NO3BrCl Mutagenic:none Tumorigenic:none Reproductive Effective:none (4E)-2-(4-bromophenyl)-4-[[3-[(2-chlorophenyl)methoxy]phenyl]methylidene]-1,3-oxazol-5-one is not a drug-like molecule.

MolName	(4E)-2-(4-bromophenyl)-4-[[3-[(2-chlorophenyl)methoxy]phenyl]methylidene]-1,3-oxazol-5-one
MolecularFormula	C23H15NO3BrCl
Smiles	O=C1OC(c(cc2)ccc2Br)=N/C1=C/c1cc(OCc(cccc2)c2Cl)ccc1
InChI	InChI=1S/C23H15BrClNO3/c24-18-10-8-16(9-11-18)22-26-21(23(27)29-22)13-15-4-3-6-19(12-15)28-14-17-5-1-2-7-20(17)25/h1-13H,14H2
InChIK	JSZQMIWTLYKPGY-UHFFFAOYSA-N
TotalMolweight	468.733
Molweight	468.733
MonoisotopicMass	466.992382
CLogP	5.2711
CLogS	-6.83
H Acceptors	4
TotalSurfaceArea	312.52
Relative PSA	0.14255
PolarSurfaceArea	47.89
Druglikeness	-0.98451
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.62069
Fragments	1
Non HAtoms	29
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	5
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	3
Symmetricatoms	2
StereoCon

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