2-(4-bromophenoxy)-N-[(E)-[(E)-1,3-diphenylprop-2-enylidene]amino]acetamide

Formula:C23H19N2O2Br Mutagenic:low Tumorigenic:none Reproductive Effective:none 2-(4-bromophenoxy)-N-[(E)-[(E)-1,3-diphenylprop-2-enylidene]amino]acetamide is not a drug-like molecule.

MolName2-(4-bromophenoxy)-N-[(E)-[(E)-1,3-diphenylprop-2-enylidene]amino]acetamide
MolecularFormulaC23H19N2O2Br
SmilesO=C(COc(cc1)ccc1Br)N/N=C(\C=C\c1ccccc1)/c1ccccc1
InChIInChI=1S/C23H19BrN2O2/c24-20-12-14-21(15-13-20)28-17-23(27)26-25-22(19-9-5-2-6-10-19)16-11-18-7-3-1-4-8-18/h1-16H,17H2,(H,26,27)
InChIKQTNUNKGWPNCRLB-UHFFFAOYSA-N
TotalMolweight435.32
Molweight435.32
MonoisotopicMass434.062989
CLogP5.2126
CLogS-6.235
H Acceptors4
H Donors1
TotalSurfaceArea313.85
Relative PSA0.1466
PolarSurfaceArea50.69
Druglikeness1.4721
Mutageniclow
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsacyl-hydrazone
Shape Index0.60714
Fragments1
Non HAtoms28
NonCHAtoms5
Electronegative Atoms5
Rotatable Bond7
Rings Closures3
Small Rings3
Aromatic Rings3
Aromatic Atoms18
Sp3Atoms2
Symmetricatoms6
StereoCon

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