(6Z)-7-phenyl-3,4-dihydro-2H-1,5,6-benzodioxazonine

Formula:C16H15NO2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (6Z)-7-phenyl-3,4-dihydro-2H-1,5,6-benzodioxazonine is a drug-like molecule.

MolName(6Z)-7-phenyl-3,4-dihydro-2H-1,5,6-benzodioxazonine
MolecularFormulaC16H15NO2
SmilesC1CO/N=C(/c2ccccc2)\c(cccc2)c2OC1
InChIInChI=1S/C16H15NO2/c1-2-7-13(8-3-1)16-14-9-4-5-10-15(14)18-11-6-12-19-17-16/h1-5,7-10H,6,11-12H2
InChIKYZAIAVVKBFPSGW-UHFFFAOYSA-N
TotalMolweight253.3
Molweight253.3
MonoisotopicMass253.110279
CLogP3.8341
CLogS-4.529
H Acceptors3
TotalSurfaceArea203.77
Relative PSA0.15464
PolarSurfaceArea30.82
Druglikeness0.38009
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.47368
Fragments1
Non HAtoms19
NonCHAtoms3
Electronegative Atoms3
Rotatable Bond1
Rings Closures3
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms5
Symmetricatoms2
StereoCon

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