(2E)-4-phenyl-N-[3-(trifluoromethyl)anilino]-1,3-thiazole-2-carboximidoyl cyanide

Formula:C18H11N4F3S Mutagenic:none Tumorigenic:none Reproductive Effective:none (2E)-4-phenyl-N-[3-(trifluoromethyl)anilino]-1,3-thiazole-2-carboximidoyl cyanide is not a drug-like molecule.

MolName	(2E)-4-phenyl-N-[3-(trifluoromethyl)anilino]-1,3-thiazole-2-carboximidoyl cyanide
MolecularFormula	C18H11N4F3S
Smiles	N#C/C(/c1nc(-c2ccccc2)cs1)=N\Nc1cc(C(F)(F)F)ccc1
InChI	InChI=1S/C18H11F3N4S/c19-18(20,21)13-7-4-8-14(9-13)24-25-15(10-22)17-23-16(11-26-17)12-5-2-1-3-6-12/h1-9,11,24H
InChIK	GYSXFOOKGLKFLK-UHFFFAOYSA-N
TotalMolweight	372.373
Molweight	372.373
MonoisotopicMass	372.06565
CLogP	5.453
CLogS	-5.243
H Acceptors	4
H Donors	1
TotalSurfaceArea	273.08
Relative PSA	0.2485
PolarSurfaceArea	89.31
Druglikeness	-7.5699
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.57692
Fragments	1
Non HAtoms	26
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	1
Symmetricatoms	4
Aromatic Nitrogens	1
StereoCon

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