[2-[(2-fluorophenyl)methylidene]-3-oxo-1-benzofuran-6-yl] acetate

Formula:C17H11O4F Mutagenic:none Tumorigenic:none Reproductive Effective:low [2-[(2-fluorophenyl)methylidene]-3-oxo-1-benzofuran-6-yl] acetate is a drug-like molecule.

MolName	[2-[(2-fluorophenyl)methylidene]-3-oxo-1-benzofuran-6-yl] acetate
MolecularFormula	C17H11O4F
Smiles	CC(Oc(cc1)cc(OC2=Cc(cccc3)c3F)c1C2=O)=O
InChI	InChI=1S/C17H11FO4/c1-10(19)21-12-6-7-13-15(9-12)22-16(17(13)20)8-11-4-2-3-5-14(11)18/h2-9H,1H3
InChIK	WHLYKCJMMHJUNA-UHFFFAOYSA-N
TotalMolweight	298.268
Molweight	298.268
MonoisotopicMass	298.064138
CLogP	3.4061
CLogS	-4.756
H Acceptors	4
TotalSurfaceArea	218.34
Relative PSA	0.21105
PolarSurfaceArea	52.6
Druglikeness	-1.3455
Mutagenic	none
Tumorigenic	none
Reproductive Effective	low
Irritant	none
Nasty Functions
Shape Index	0.59091
Fragments	1
Non HAtoms	22
NonCHAtoms	5
Electronegative Atoms	5
Rotatable Bond	3
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	3
StereoCon

Click to Load Molecule:

1 - [2-[(2-fluorophenyl)methylidene]-3-oxo-1-benzofuran-6-yl] acetate | 2 - [2-[(2-fluorophenyl)methylidene]-3-oxo-1-benzofuran-6-yl] acetate

Request More Details | [2-[(2-fluorophenyl)methylidene]-3-oxo-1-benzofuran-6-yl] acetate

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments