(E)-3-(3,4-dichlorophenyl)-N-[2-[[(E)-3-(3,4-dichlorophenyl)prop-2-enoyl]amino]ethyl]prop-2-enamide

Formula:C20H16N2O2Cl4 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-3-(3,4-dichlorophenyl)-N-[2-[[(E)-3-(3,4-dichlorophenyl)prop-2-enoyl]amino]ethyl]prop-2-enamide is not a drug-like molecule.

MolName(E)-3-(3,4-dichlorophenyl)-N-[2-[[(E)-3-(3,4-dichlorophenyl)prop-2-enoyl]amino]ethyl]prop-2-enamide
MolecularFormulaC20H16N2O2Cl4
SmilesO=C(/C=C/c(cc1)cc(Cl)c1Cl)NCCNC(/C=C/c(cc1)cc(Cl)c1Cl)=O
InChIInChI=1S/C20H16Cl4N2O2/c21-15-5-1-13(11-17(15)23)3-7-19(27)25-9-10-26-20(28)8-4-14-2-6-16(22)18(24)12-14/h1-8,11-12H,9-10H2,(H,25,27)(H,26,28)
InChIKXDTCHVSMAHKIHX-UHFFFAOYSA-N
TotalMolweight458.171
Molweight458.171
MonoisotopicMass455.996586
CLogP5.1146
CLogS-6.542
H Acceptors4
H Donors2
TotalSurfaceArea333.64
Relative PSA0.14686
PolarSurfaceArea58.2
Druglikeness1.0858
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.71429
Fragments1
Non HAtoms28
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond7
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms2
Symmetricatoms14
Amides2
StereoCon

Request More Details | (E)-3-(3,4-dichlorophenyl)-N-[2-[[(E)-3-(3,4-dichlorophenyl)prop-2-enoyl]amino]ethyl]prop-2-enamide


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