(E)-3-(4-bromophenyl)-N-[2-(3-bromophenyl)-1,3-benzoxazol-5-yl]prop-2-en-1-imine

Formula:C22H14N2OBr2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-3-(4-bromophenyl)-N-[2-(3-bromophenyl)-1,3-benzoxazol-5-yl]prop-2-en-1-imine is not a drug-like molecule.

MolName	(E)-3-(4-bromophenyl)-N-[2-(3-bromophenyl)-1,3-benzoxazol-5-yl]prop-2-en-1-imine
MolecularFormula	C22H14N2OBr2
Smiles	Brc1ccc(/C=C/C=N/c(cc2)cc3c2oc(-c2cccc(Br)c2)n3)cc1
InChI	InChI=1S/C22H14Br2N2O/c23-17-8-6-15(7-9-17)3-2-12-25-19-10-11-21-20(14-19)26-22(27-21)16-4-1-5-18(24)13-16/h1-14H
InChIK	FWSQFKKPUJSYKP-UHFFFAOYSA-N
TotalMolweight	482.174
Molweight	482.174
MonoisotopicMass	479.947285
CLogP	6.1569
CLogS	-8.108
H Acceptors	3
TotalSurfaceArea	304.35
Relative PSA	0.12022
PolarSurfaceArea	38.39
Druglikeness	-1.7852
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.66667
Fragments	1
Non HAtoms	27
NonCHAtoms	5
Electronegative Atoms	5
Rotatable Bond	4
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	21
Symmetricatoms	2
Aromatic Nitrogens	1
StereoCon

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