(Z)-3-(4-bromophenyl)-N-(4-phenylbutyl)prop-2-enamide

Formula:C19H20NOBr Mutagenic:none Tumorigenic:none Reproductive Effective:none (Z)-3-(4-bromophenyl)-N-(4-phenylbutyl)prop-2-enamide is a drug-like molecule.

MolName(Z)-3-(4-bromophenyl)-N-(4-phenylbutyl)prop-2-enamide
MolecularFormulaC19H20NOBr
SmilesO=C(/C=C\c(cc1)ccc1Br)NCCCCc1ccccc1
InChIInChI=1S/C19H20BrNO/c20-18-12-9-17(10-13-18)11-14-19(22)21-15-5-4-8-16-6-2-1-3-7-16/h1-3,6-7,9-14H,4-5,8,15H2,(H,21,22)
InChIKLFLCYPCZNMBBDF-UHFFFAOYSA-N
TotalMolweight358.278
Molweight358.278
MonoisotopicMass357.072825
CLogP4.9098
CLogS-4.8
H Acceptors2
H Donors1
TotalSurfaceArea262.4
Relative PSA0.093369
PolarSurfaceArea29.1
Druglikeness-5.6811
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.77273
Fragments1
Non HAtoms22
NonCHAtoms3
Electronegative Atoms3
Rotatable Bond7
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms4
Symmetricatoms4
Amides1
StereoCon

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