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

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

MolName	(E)-3-(3-bromophenyl)-N-[2-(4-bromophenyl)-1,3-benzoxazol-5-yl]prop-2-en-1-imine
MolecularFormula	C22H14N2OBr2
Smiles	Brc(cc1)ccc1-c1nc(cc(cc2)/N=C/C=C/c3cccc(Br)c3)c2o1
InChI	InChI=1S/C22H14Br2N2O/c23-17-8-6-16(7-9-17)22-26-20-14-19(10-11-21(20)27-22)25-12-2-4-15-3-1-5-18(24)13-15/h1-14H
InChIK	QVMWRPAYRJVWRJ-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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