2-phenyl-N-[(Z)-(1,1,1-trifluoro-4-oxo-4-thiophen-3-ylbutan-2-ylidene)amino]acetamide

Formula:C16H13N2O2F3S Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-phenyl-N-[(Z)-(1,1,1-trifluoro-4-oxo-4-thiophen-3-ylbutan-2-ylidene)amino]acetamide is a drug-like molecule.

MolName	2-phenyl-N-[(Z)-(1,1,1-trifluoro-4-oxo-4-thiophen-3-ylbutan-2-ylidene)amino]acetamide
MolecularFormula	C16H13N2O2F3S
Smiles	O=C(C/C(/C(F)(F)F)=N/NC(Cc1ccccc1)=O)c1cscc1
InChI	InChI=1S/C16H13F3N2O2S/c17-16(18,19)14(9-13(22)12-6-7-24-10-12)20-21-15(23)8-11-4-2-1-3-5-11/h1-7,10H,8-9H2,(H,21,23)
InChIK	SLMSNOZRTVENJP-UHFFFAOYSA-N
TotalMolweight	354.351
Molweight	354.351
MonoisotopicMass	354.064982
CLogP	3.2621
CLogS	-4.878
H Acceptors	4
H Donors	1
TotalSurfaceArea	255.87
Relative PSA	0.27127
PolarSurfaceArea	86.77
Druglikeness	-7.0127
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone
Shape Index	0.58333
Fragments	1
Non HAtoms	24
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	7
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	3
Symmetricatoms	4
StereoCon

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1 - 2-phenyl-N-[(Z)-(1,1,1-trifluoro-4-oxo-4-thiophen-3-ylbutan-2-ylidene)amino]acetamide | 2 - 2-phenyl-N-[(Z)-(1,1,1-trifluoro-4-oxo-4-thiophen-3-ylbutan-2-ylidene)amino]acetamide

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