4-bromo-N'-[(1E)-cycloocten-1-yl]benzohydrazide

Formula:C15H19N2OBr Mutagenic:none Tumorigenic:none Reproductive Effective:none 4-bromo-N'-[(1E)-cycloocten-1-yl]benzohydrazide is a drug-like molecule.

MolName4-bromo-N'-[(1E)-cycloocten-1-yl]benzohydrazide
MolecularFormulaC15H19N2OBr
SmilesO=C(c(cc1)ccc1Br)NN/C1=C/CCCCCC1
InChIInChI=1S/C15H19BrN2O/c16-13-10-8-12(9-11-13)15(19)18-17-14-6-4-2-1-3-5-7-14/h6,8-11,17H,1-5,7H2,(H,18,19)
InChIKNIHLRASTUCTZJI-UHFFFAOYSA-N
TotalMolweight323.233
Molweight323.233
MonoisotopicMass322.068074
CLogP4.4144
CLogS-4.908
H Acceptors3
H Donors2
TotalSurfaceArea226.33
Relative PSA0.15888
PolarSurfaceArea41.13
Druglikeness-5.6624
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.68421
Fragments1
Non HAtoms19
NonCHAtoms4
Electronegative Atoms4
Rotatable Bond3
Rings Closures2
Small Rings1
Aromatic Rings1
Aromatic Atoms6
Sp3Atoms7
Symmetricatoms2
StereoCon

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