(2E)-1-Phenyl-2-[(2Z)-3-phenylprop-2-en-1-ylidene]hydrazine

CAS Number: 1216-15-5
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C(/C=N/Nc1ccccc1)=C\c1ccccc1
Molecule Information
Mutagenic: none Tumorigenic: high Irritant: none
Formula
C15H14N2
Molecular Weight
222.29
Drug-likeness
2.2952
CAS
1216-15-5
InChI key
WKFCGJZYIWAEEX-UHFFFAOYSA-N
SMILES
C(/C=N/Nc1ccccc1)=C\c1ccccc1
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
high
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 1216-15-5
Molecule Name (2E)-1-Phenyl-2-[(2Z)-3-phenylprop-2-en-1-ylidene]hydrazine
Molecular Formula C15H14N2
SMILES C(/C=N/Nc1ccccc1)=C\c1ccccc1
InChI InChI=1S/C15H14N2/c1-3-8-14(9-4-1)10-7-13-16-17-15-11-5-2-6-12-15/h1-13,17H
InChI Key WKFCGJZYIWAEEX-UHFFFAOYSA-N
CanonicalSyTyLFy b54d46df2616265f
TotalMolweight 222.29
Molecular Weight 222.29
MonoisotopicMass 222.115698
CLogP 4.8592
CLogS -3.441
H Acceptors 2
H Donors 1
TotalSurfaceArea 195.74
Relative PSA 0.11735
PolarSurfaceArea 24.39
Drug-likeness 2.2952
Mutagenic none
Tumorigenic high
Reproductive Effective none
Irritant none
Nasty Functions imine/hydrazone of aldehyde
Shape Index 0.76471
Molecula Flexibility 0.33981
Molecular Complexity 0.45401
Fragments 1
Non HAtoms 17
NonCHAtoms 2
Electronegative Atoms 2
Rotatable Bond 4
Rings Closures 2
Small Rings 2
Aromatic Rings 2
Aromatic Atoms 12
Symmetricatoms 4

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