N-Benzylidene-N-(diphenylmethyl)amine

CAS Number: 62506-88-1
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C(c1ccccc1)=N/C(c1ccccc1)c1ccccc1
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
C20H17N
Molecular Weight
271.362
Drug-likeness
0.44659
CAS
62506-88-1
InChI key
OVAMCIQDVMEHAG-LTGZKZEYSA-N
SMILES
C(c1ccccc1)=N/C(c1ccccc1)c1ccccc1
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 62506-88-1
Molecule Name N-Benzylidene-N-(diphenylmethyl)amine
Molecular Formula C20H17N
SMILES C(c1ccccc1)=N/C(c1ccccc1)c1ccccc1
InChI InChI=1S/C20H17N/c1-4-10-17(11-5-1)16-21-20(18-12-6-2-7-13-18)19-14-8-3-9-15-19/h1-16,20H/b21-16+
InChI Key OVAMCIQDVMEHAG-LTGZKZEYSA-N
CanonicalSyTyLFy 3d45f2d5c15ae237
TotalMolweight 271.362
Molecular Weight 271.362
MonoisotopicMass 271.136099
CLogP 4.8532
CLogS -4.579
H Acceptors 1
TotalSurfaceArea 230.04
Relative PSA 0.050035
PolarSurfaceArea 12.36
Drug-likeness 0.44659
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Nasty Functions imine/hydrazone of aldehyde
Shape Index 0.52381
Molecula Flexibility 0.45881
Molecular Complexity 0.56169
Fragments 1
Non HAtoms 21
NonCHAtoms 1
Electronegative Atoms 1
Rotatable Bond 4
Rings Closures 3
Small Rings 3
Aromatic Rings 3
Aromatic Atoms 18
Sp3Atoms 1
Symmetricatoms 10
BasicNitrogens 1

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