N-[(E)-3-oxo-1-thiophen-2-yl-3-[3-(trifluoromethyl)anilino]prop-1-en-2-yl]furan-2-carboxamide

Formula:C19H13N2O3F3S Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(E)-3-oxo-1-thiophen-2-yl-3-[3-(trifluoromethyl)anilino]prop-1-en-2-yl]furan-2-carboxamide is a drug-like molecule.

MolName	N-[(E)-3-oxo-1-thiophen-2-yl-3-[3-(trifluoromethyl)anilino]prop-1-en-2-yl]furan-2-carboxamide
MolecularFormula	C19H13N2O3F3S
Smiles	O=C(/C(/NC(c1ccco1)=O)=C\c1cccs1)Nc1cc(C(F)(F)F)ccc1
InChI	InChI=1S/C19H13F3N2O3S/c20-19(21,22)12-4-1-5-13(10-12)23-17(25)15(11-14-6-3-9-28-14)24-18(26)16-7-2-8-27-16/h1-11H,(H,23,25)(H,24,26)
InChIK	LIVUSSDQYZTMTE-UHFFFAOYSA-N
TotalMolweight	406.383
Molweight	406.383
MonoisotopicMass	406.059897
CLogP	4.3274
CLogS	-5.343
H Acceptors	5
H Donors	2
TotalSurfaceArea	291
Relative PSA	0.28684
PolarSurfaceArea	99.58
Druglikeness	-2.9077
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.46429
Fragments	1
Non HAtoms	28
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	16
Sp3Atoms	1
Symmetricatoms	2
Amides	2
StereoCon

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