(2-benzylphenyl)(naphthalen-2-yl)methanone

CAS Number: 7424-65-9
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O=C(c1cc2ccccc2cc1)c1c(Cc2ccccc2)cccc1
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
C24H18O
Molecular Weight
322.406
Drug-likeness
-1.2328
CAS
7424-65-9
InChI key
NVWHNYALVTZDHG-UHFFFAOYSA-N
SMILES
O=C(c1cc2ccccc2cc1)c1c(Cc2ccccc2)cccc1
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 7424-65-9
Molecule Name (2-benzylphenyl)(naphthalen-2-yl)methanone
Molecular Formula C24H18O
SMILES O=C(c1cc2ccccc2cc1)c1c(Cc2ccccc2)cccc1
InChI InChI=1S/C24H18O/c25-24(22-15-14-19-10-4-5-11-20(19)17-22)23-13-7-6-12-21(23)16-18-8-2-1-3-9-18/h1-15,17H,16H2
InChI Key NVWHNYALVTZDHG-UHFFFAOYSA-N
CanonicalSyTyLFy 5e23167d811a312c
TotalMolweight 322.406
Molecular Weight 322.406
MonoisotopicMass 322.135765
CLogP 5.7999
CLogS -7.033
H Acceptors 1
TotalSurfaceArea 258.89
Relative PSA 0.050369
PolarSurfaceArea 17.07
Drug-likeness -1.2328
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.56
Molecula Flexibility 0.49037
Molecular Complexity 0.74654
Fragments 1
Non HAtoms 25
NonCHAtoms 1
Electronegative Atoms 1
Rotatable Bond 4
Rings Closures 4
Small Rings 4
Aromatic Rings 4
Aromatic Atoms 22
Sp3Atoms 1
Symmetricatoms 2

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