(Z)-3-[(Z)-1,3-benzodioxol-5-ylmethylideneamino]-4-(1-benzofuran-2-yl)-N-(2,4-difluorophenyl)-1,3-thiazol-2-imine

Formula:C25H15N3O3F2S Mutagenic:none Tumorigenic:none Reproductive Effective:none (Z)-3-[(Z)-1,3-benzodioxol-5-ylmethylideneamino]-4-(1-benzofuran-2-yl)-N-(2,4-difluorophenyl)-1,3-thiazol-2-imine is not a drug-like molecule.

MolName	(Z)-3-[(Z)-1,3-benzodioxol-5-ylmethylideneamino]-4-(1-benzofuran-2-yl)-N-(2,4-difluorophenyl)-1,3-thiazol-2-imine
MolecularFormula	C25H15N3O3F2S
Smiles	Fc(cc1)cc(F)c1/N=C1\SC=C(c2cc(cccc3)c3o2)N1/N=C\c(cc1)cc2c1OCO2
InChI	InChI=1S/C25H15F2N3O3S/c26-17-6-7-19(18(27)11-17)29-25-30(28-12-15-5-8-22-24(9-15)32-14-31-22)20(13-34-25)23-10-16-3-1-2-4-21(16)33-23/h1-13H,14H2
InChIK	HMBCAHPASAOPGP-UHFFFAOYSA-N
TotalMolweight	475.474
Molweight	475.474
MonoisotopicMass	475.080218
CLogP	6.1827
CLogS	-8.156
H Acceptors	6
TotalSurfaceArea	336.76
Relative PSA	0.23212
PolarSurfaceArea	84.86
Druglikeness	2.47
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.44118
Fragments	1
Non HAtoms	34
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	4
Rings Closures	6
Small Rings	6
Aromatic Rings	4
Aromatic Atoms	21
Sp3Atoms	4
StereoCon

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1 - (Z)-3-[(Z)-1,3-benzodioxol-5-ylmethylideneamino]-4-(1-benzofuran-2-yl)-N-(2,4-difluorophenyl)-1,3-thiazol-2-imine | 2 - (Z)-3-[(Z)-1,3-benzodioxol-5-ylmethylideneamino]-4-(1-benzofuran-2-yl)-N-(2,4-difluorophenyl)-1,3-thiazol-2-imine

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