5-bromo-N-[(Z)-(2-chloro-6-fluorophenyl)methylideneamino]-2-hydroxybenzamide

Formula:C14H9N2O2BrClF Mutagenic:none Tumorigenic:none Reproductive Effective:none 5-bromo-N-[(Z)-(2-chloro-6-fluorophenyl)methylideneamino]-2-hydroxybenzamide is a drug-like molecule.

MolName5-bromo-N-[(Z)-(2-chloro-6-fluorophenyl)methylideneamino]-2-hydroxybenzamide
MolecularFormulaC14H9N2O2BrClF
SmilesOc(ccc(Br)c1)c1C(N/N=C\c(c(F)ccc1)c1Cl)=O
InChIInChI=1S/C14H9BrClFN2O2/c15-8-4-5-13(20)9(6-8)14(21)19-18-7-10-11(16)2-1-3-12(10)17/h1-7,20H,(H,19,21)
InChIKUORYURDKTAIZPX-UHFFFAOYSA-N
TotalMolweight371.592
Molweight371.592
MonoisotopicMass369.951994
CLogP4.2879
CLogS-5.309
H Acceptors4
H Donors2
TotalSurfaceArea233.74
Relative PSA0.21011
PolarSurfaceArea61.69
Druglikeness1.2998
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.57143
Fragments1
Non HAtoms21
NonCHAtoms7
Electronegative Atoms7
Rotatable Bond3
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms1
StereoCon

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