N-[2-[(E)-[amino(phenyl)methylidene]amino]oxy-1,1,1,3,3,3-hexafluoropropan-2-yl]benzamide

Formula:C17H13N3O2F6 Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[2-[(E)-[amino(phenyl)methylidene]amino]oxy-1,1,1,3,3,3-hexafluoropropan-2-yl]benzamide is a drug-like molecule.

MolNameN-[2-[(E)-[amino(phenyl)methylidene]amino]oxy-1,1,1,3,3,3-hexafluoropropan-2-yl]benzamide
MolecularFormulaC17H13N3O2F6
SmilesN/C(/c1ccccc1)=N/OC(C(F)(F)F)(C(F)(F)F)NC(c1ccccc1)=O
InChIInChI=1S/C17H13F6N3O2/c18-16(19,20)15(17(21,22)23,25-14(27)12-9-5-2-6-10-12)28-26-13(24)11-7-3-1-4-8-11/h1-10H,(H2,24,26)(H,25,27)
InChIKSGFIPVJRQPQPJU-UHFFFAOYSA-N
TotalMolweight405.297
Molweight405.297
MonoisotopicMass405.091195
CLogP4.6342
CLogS-5.369
H Acceptors5
H Donors2
TotalSurfaceArea273.05
Relative PSA0.22443
PolarSurfaceArea76.71
Druglikeness-9.1237
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.5
Fragments1
Non HAtoms28
NonCHAtoms11
Electronegative Atoms11
Rotatable Bond7
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms4
Symmetricatoms10
Amides1
StereoCon

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