(Z)-N-[(Z)-1,3-benzodioxol-5-ylmethylideneamino]-4-(4-bromophenyl)-3-phenyl-1,3-thiazol-2-imine

Formula:C23H16N3O2BrS Mutagenic:none Tumorigenic:none Reproductive Effective:none (Z)-N-[(Z)-1,3-benzodioxol-5-ylmethylideneamino]-4-(4-bromophenyl)-3-phenyl-1,3-thiazol-2-imine is not a drug-like molecule.

MolName	(Z)-N-[(Z)-1,3-benzodioxol-5-ylmethylideneamino]-4-(4-bromophenyl)-3-phenyl-1,3-thiazol-2-imine
MolecularFormula	C23H16N3O2BrS
Smiles	Brc(cc1)ccc1C(N1c2ccccc2)=CS/C1=N/N=C\c(cc1)cc2c1OCO2
InChI	InChI=1S/C23H16BrN3O2S/c24-18-9-7-17(8-10-18)20-14-30-23(27(20)19-4-2-1-3-5-19)26-25-13-16-6-11-21-22(12-16)29-15-28-21/h1-14H,15H2
InChIK	RFSZQRGZHHIHLJ-UHFFFAOYSA-N
TotalMolweight	478.369
Molweight	478.369
MonoisotopicMass	477.014658
CLogP	7.79
CLogS	-8.041
H Acceptors	5
TotalSurfaceArea	318.4
Relative PSA	0.20119
PolarSurfaceArea	71.72
Druglikeness	1.4721
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	dimethylene-hydrazine; imine/hydrazone of aldehyde
Shape Index	0.53333
Fragments	1
Non HAtoms	30
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	4
Rings Closures	5
Small Rings	5
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	4
Symmetricatoms	4
StereoCon

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