[2,4-dibromo-6-[(Z)-[[2-[(4-chlorobenzoyl)amino]acetyl]hydrazinylidene]methyl]phenyl] 3-bromobenzoate

Formula:C23H15N3O4Br3Cl Mutagenic:none Tumorigenic:none Reproductive Effective:high [2,4-dibromo-6-[(Z)-[[2-[(4-chlorobenzoyl)amino]acetyl]hydrazinylidene]methyl]phenyl] 3-bromobenzoate is not a drug-like molecule.

MolName[2,4-dibromo-6-[(Z)-[[2-[(4-chlorobenzoyl)amino]acetyl]hydrazinylidene]methyl]phenyl] 3-bromobenzoate
MolecularFormulaC23H15N3O4Br3Cl
SmilesO=C(CNC(c(cc1)ccc1Cl)=O)N/N=C\c1cc(Br)cc(Br)c1OC(c1cc(Br)ccc1)=O
InChIInChI=1S/C23H15Br3ClN3O4/c24-16-3-1-2-14(8-16)23(33)34-21-15(9-17(25)10-19(21)26)11-29-30-20(31)12-28-22(32)13-4-6-18(27)7-5-13/h1-11H,12H2,(H,28,32)(H,30,31)
InChIKKFSQNBTYNVBWMZ-UHFFFAOYSA-N
TotalMolweight672.554
Molweight672.554
MonoisotopicMass668.830117
CLogP6.4974
CLogS-8.196
H Acceptors7
H Donors2
TotalSurfaceArea388.78
Relative PSA0.2149
PolarSurfaceArea96.86
Druglikeness3.3116
Mutagenicnone
Tumorigenicnone
Reproductive Effectivehigh
Irritantnone
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.58824
Fragments1
Non HAtoms34
NonCHAtoms11
Electronegative Atoms11
Rotatable Bond8
Rings Closures3
Small Rings3
Aromatic Rings3
Aromatic Atoms18
Sp3Atoms2
Symmetricatoms2
Amides1
StereoCon

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