(E)-3-(4-chlorophenyl)-N-[2-(4-fluorobenzoyl)-1-benzofuran-3-yl]prop-2-enamide

Formula:C24H15NO3ClF Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-3-(4-chlorophenyl)-N-[2-(4-fluorobenzoyl)-1-benzofuran-3-yl]prop-2-enamide is not a drug-like molecule.

MolName(E)-3-(4-chlorophenyl)-N-[2-(4-fluorobenzoyl)-1-benzofuran-3-yl]prop-2-enamide
MolecularFormulaC24H15NO3ClF
SmilesO=C(/C=C/c(cc1)ccc1Cl)Nc1c(C(c(cc2)ccc2F)=O)oc2c1cccc2
InChIInChI=1S/C24H15ClFNO3/c25-17-10-5-15(6-11-17)7-14-21(28)27-22-19-3-1-2-4-20(19)30-24(22)23(29)16-8-12-18(26)13-9-16/h1-14H,(H,27,28)
InChIKRQTOXANQARNYAQ-UHFFFAOYSA-N
TotalMolweight419.838
Molweight419.838
MonoisotopicMass419.072449
CLogP5.4787
CLogS-7.831
H Acceptors4
H Donors1
TotalSurfaceArea312.3
Relative PSA0.16539
PolarSurfaceArea59.31
Druglikeness-0.12277
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.56667
Fragments1
Non HAtoms30
NonCHAtoms6
Electronegative Atoms6
Rotatable Bond5
Rings Closures4
Small Rings4
Aromatic Rings4
Aromatic Atoms21
Symmetricatoms4
Amides1
StereoCon

Request More Details | (E)-3-(4-chlorophenyl)-N-[2-(4-fluorobenzoyl)-1-benzofuran-3-yl]prop-2-enamide


SKU Product Name Product Unit Qty Supplier Email
User Name
User Email
Additional Comments