(5E)-3-prop-2-ynyl-5-[[3-(trifluoromethyl)phenyl]methylidene]-1,3-thiazolidine-2,4-dione

Formula:C14H8NO2F3S Mutagenic:none Tumorigenic:none Reproductive Effective:none (5E)-3-prop-2-ynyl-5-[[3-(trifluoromethyl)phenyl]methylidene]-1,3-thiazolidine-2,4-dione is a drug-like molecule.

MolName	(5E)-3-prop-2-ynyl-5-[[3-(trifluoromethyl)phenyl]methylidene]-1,3-thiazolidine-2,4-dione
MolecularFormula	C14H8NO2F3S
Smiles	C#CCN(C(/C(/S1)=C\c2cc(C(F)(F)F)ccc2)=O)C1=O
InChI	InChI=1S/C14H8F3NO2S/c1-2-6-18-12(19)11(21-13(18)20)8-9-4-3-5-10(7-9)14(15,16)17/h1,3-5,7-8H,6H2
InChIK	OBYVZYGDCUKQIP-UHFFFAOYSA-N
TotalMolweight	311.283
Molweight	311.283
MonoisotopicMass	311.022783
CLogP	2.6178
CLogS	-4.189
H Acceptors	3
TotalSurfaceArea	214.79
Relative PSA	0.21938
PolarSurfaceArea	62.68
Druglikeness	-2.7559
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	limit! methylene-thiazolidine-2,4-dione
Shape Index	0.57143
Fragments	1
Non HAtoms	21
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	3
Rings Closures	2
Small Rings	2
Aromatic Rings	1
Aromatic Atoms	6
Sp3Atoms	3
Symmetricatoms	2
Amides	1
StereoCon

Click to Load Molecule:

1 - (5E)-3-prop-2-ynyl-5-[[3-(trifluoromethyl)phenyl]methylidene]-1,3-thiazolidine-2,4-dione | 2 - (5E)-3-prop-2-ynyl-5-[[3-(trifluoromethyl)phenyl]methylidene]-1,3-thiazolidine-2,4-dione

Request More Details | (5E)-3-prop-2-ynyl-5-[[3-(trifluoromethyl)phenyl]methylidene]-1,3-thiazolidine-2,4-dione

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments