1-N,3-N-bis[(Z)-(3-bromophenyl)methylideneamino]benzene-1,3-dicarboxamide

Formula:C22H16N4O2Br2 Mutagenic:none Tumorigenic:none Reproductive Effective:none 1-N,3-N-bis[(Z)-(3-bromophenyl)methylideneamino]benzene-1,3-dicarboxamide is not a drug-like molecule.

MolName1-N,3-N-bis[(Z)-(3-bromophenyl)methylideneamino]benzene-1,3-dicarboxamide
MolecularFormulaC22H16N4O2Br2
SmilesO=C(c1cccc(C(N/N=C\c2cccc(Br)c2)=O)c1)N/N=C\c1cc(Br)ccc1
InChIInChI=1S/C22H16Br2N4O2/c23-19-8-1-4-15(10-19)13-25-27-21(29)17-6-3-7-18(12-17)22(30)28-26-14-16-5-2-9-20(24)11-16/h1-14H,(H,27,29)(H,28,30)
InChIKFINBAZCEYFHVLL-UHFFFAOYSA-N
TotalMolweight528.203
Molweight528.203
MonoisotopicMass525.963998
CLogP6.194
CLogS-7.494
H Acceptors6
H Donors2
TotalSurfaceArea337.98
Relative PSA0.21309
PolarSurfaceArea82.92
Druglikeness2.6787
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.63333
Fragments1
Non HAtoms30
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond6
Rings Closures3
Small Rings3
Aromatic Rings3
Aromatic Atoms18
Symmetricatoms14
StereoCon

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