(Z)-1-(1,3-benzodioxol-4-yl)-N-[(5-naphthalen-2-yl-1,3,4-oxadiazol-2-yl)methoxy]methanimine

Formula:C21H15N3O4 Mutagenic:none Tumorigenic:none Reproductive Effective:none (Z)-1-(1,3-benzodioxol-4-yl)-N-[(5-naphthalen-2-yl-1,3,4-oxadiazol-2-yl)methoxy]methanimine is a drug-like molecule.

MolName(Z)-1-(1,3-benzodioxol-4-yl)-N-[(5-naphthalen-2-yl-1,3,4-oxadiazol-2-yl)methoxy]methanimine
MolecularFormulaC21H15N3O4
SmilesC(c1nnc(-c2cc3ccccc3cc2)o1)O/N=C\c1c2OCOc2ccc1
InChIInChI=1S/C21H15N3O4/c1-2-5-15-10-16(9-8-14(15)4-1)21-24-23-19(28-21)12-27-22-11-17-6-3-7-18-20(17)26-13-25-18/h1-11H,12-13H2
InChIKOZHYRDCLPSPGOM-UHFFFAOYSA-N
TotalMolweight373.367
Molweight373.367
MonoisotopicMass373.106257
CLogP4.8561
CLogS-6.972
H Acceptors7
TotalSurfaceArea283.37
Relative PSA0.27371
PolarSurfaceArea78.97
Druglikeness1.2845
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.60714
Fragments1
Non HAtoms28
NonCHAtoms7
Electronegative Atoms7
Rotatable Bond5
Rings Closures5
Small Rings5
Aromatic Rings4
Aromatic Atoms21
Sp3Atoms5
Aromatic Nitrogens2
StereoCon

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