10-phenyl-3-[(E)-2-phenylethenyl]-9-oxa-3-azaspiro[5.5]undeca-1,4,10-trien-8-one

Formula:C23H19NO2 Mutagenic:none Tumorigenic:none Reproductive Effective:none 10-phenyl-3-[(E)-2-phenylethenyl]-9-oxa-3-azaspiro[5.5]undeca-1,4,10-trien-8-one is a drug-like molecule.

MolName10-phenyl-3-[(E)-2-phenylethenyl]-9-oxa-3-azaspiro[5.5]undeca-1,4,10-trien-8-one
MolecularFormulaC23H19NO2
SmilesO=C(C1)OC(c2ccccc2)=CC11C=CN(/C=C/c2ccccc2)C=C1
InChIInChI=1S/C23H19NO2/c25-22-18-23(17-21(26-22)20-9-5-2-6-10-20)12-15-24(16-13-23)14-11-19-7-3-1-4-8-19/h1-17H,18H2
InChIKCYUXADDTDFVCAB-UHFFFAOYSA-N
TotalMolweight341.409
Molweight341.409
MonoisotopicMass341.141579
CLogP3.4927
CLogS-4.869
H Acceptors3
TotalSurfaceArea272.45
Relative PSA0.097596
PolarSurfaceArea29.54
Druglikeness-0.32491
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.61538
Fragments1
Non HAtoms26
NonCHAtoms3
Electronegative Atoms3
Rotatable Bond3
Rings Closures4
Small Rings4
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms4
Symmetricatoms6
BasicNitrogens1
StereoCon

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