[2-oxo-2-(2-phenoxyanilino)ethyl] (E)-3-[3-(trifluoromethyl)phenyl]prop-2-enoate

Formula:C24H18NO4F3 Mutagenic:none Tumorigenic:none Reproductive Effective:none [2-oxo-2-(2-phenoxyanilino)ethyl] (E)-3-[3-(trifluoromethyl)phenyl]prop-2-enoate is a drug-like molecule.

MolName	[2-oxo-2-(2-phenoxyanilino)ethyl] (E)-3-[3-(trifluoromethyl)phenyl]prop-2-enoate
MolecularFormula	C24H18NO4F3
Smiles	O=C(COC(/C=C/c1cccc(C(F)(F)F)c1)=O)Nc(cccc1)c1Oc1ccccc1
InChI	InChI=1S/C24H18F3NO4/c25-24(26,27)18-8-6-7-17(15-18)13-14-23(30)31-16-22(29)28-20-11-4-5-12-21(20)32-19-9-2-1-3-10-19/h1-15H,16H2,(H,28,29)
InChIK	YJHKHFKZUUUKLX-UHFFFAOYSA-N
TotalMolweight	441.404
Molweight	441.404
MonoisotopicMass	441.118793
CLogP	4.9381
CLogS	-6.476
H Acceptors	5
H Donors	1
TotalSurfaceArea	329.46
Relative PSA	0.17465
PolarSurfaceArea	64.63
Druglikeness	-7.0964
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.59375
Fragments	1
Non HAtoms	32
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	9
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	4
Symmetricatoms	4
Amides	1
StereoCon

Click to Load Molecule:

1 - [2-oxo-2-(2-phenoxyanilino)ethyl] (E)-3-[3-(trifluoromethyl)phenyl]prop-2-enoate | 2 - [2-oxo-2-(2-phenoxyanilino)ethyl] (E)-3-[3-(trifluoromethyl)phenyl]prop-2-enoate

Request More Details | [2-oxo-2-(2-phenoxyanilino)ethyl] (E)-3-[3-(trifluoromethyl)phenyl]prop-2-enoate

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments