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C16H15NO2 | Cheminformatics

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

Molecular 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

MolecularFormula : C16H15NO2

Smiles : C1CO/N=C(/c2ccccc2)\c(cccc2)c2OC1

InChI : InChI=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

InChIK : YZAIAVVKBFPSGW-UHFFFAOYSA-N

TotalMolweight : 253.3

Molweight : 253.3

MonoisotopicMass : 253.110279

CLogP : 3.8341

CLogS : -4.529

H Acceptors : 3

TotalSurfaceArea : 203.77

Relative PSA : 0.15464

PolarSurfaceArea : 30.82

Druglikeness : 0.38009

Mutagenic : none

Tumorigenic : none

Reproductive Effective : none

Irritant : none

Nasty Functions :

Shape Index : 0.47368

Fragments : 1

Non HAtoms : 19

NonCHAtoms : 3

Electronegative Atoms : 3

Rotatable Bond : 1

Rings Closures : 3

Small Rings : 2

Aromatic Rings : 2

Aromatic Atoms : 12

Sp3Atoms : 5

Symmetricatoms : 2

StereoCon :

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