2-Oxazolidinone, 4-(diphenylmethyl)-3-(1,2-propadienyl)-, (4R)-

Formula:C19H17NO2 CAS:256382-53-3 ChemrytIQ

PropertyValue
Casrn256382-53-3
MolName2-Oxazolidinone, 4-(diphenylmethyl)-3-(1,2-propadienyl)-, (4R)-
MolecularFormulaC19H17NO2
SmilesC=C=CN([C@@H](CO1)C(c2ccccc2)c2ccccc2)C1=O
InChIInChI=1S/C19H17NO2/c1-2-13-20-17(14-22-19(20)21)18(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-13,17-18H,1,14H2/t17-/m1/s1
InChIKVYMLNEVDRQOXOQ-QGZVFWFLSA-N
CanonicalSyTyLFydf04cdd89d722972
TotalMolweight291.349
Molweight291.349
MonoisotopicMass291.125929
CLogP3.3677
CLogS-3.903
H Acceptors3
TotalSurfaceArea233.39
Relative PSA0.11393
PolarSurfaceArea29.54
Druglikeness-3.7765
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.45455
Molecula Flexibility0.39328
Molecular Complexity0.72502
Fragments1
Non HAtoms22
NonCHAtoms3
Electronegative Atoms3
StereoCenters1
Rotatable Bond4
Rings Closures3
Small Rings3
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms4
Symmetricatoms8
Amides1
StereoConthis enantiomer
CAS Number Mutagenic Tumorigenic Irritant Molecule Formula Mol Weight Druglikeness ChemrytIQ
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