[3-[(Z)-[[2-[(4-fluorobenzoyl)amino]acetyl]hydrazinylidene]methyl]phenyl] 2,4-dichlorobenzoate

Formula:C23H16N3O4Cl2F Mutagenic:none Tumorigenic:none Reproductive Effective:none [3-[(Z)-[[2-[(4-fluorobenzoyl)amino]acetyl]hydrazinylidene]methyl]phenyl] 2,4-dichlorobenzoate is not a drug-like molecule.

MolName[3-[(Z)-[[2-[(4-fluorobenzoyl)amino]acetyl]hydrazinylidene]methyl]phenyl] 2,4-dichlorobenzoate
MolecularFormulaC23H16N3O4Cl2F
SmilesO=C(CNC(c(cc1)ccc1F)=O)N/N=C\c1cccc(OC(c(ccc(Cl)c2)c2Cl)=O)c1
InChIInChI=1S/C23H16Cl2FN3O4/c24-16-6-9-19(20(25)11-16)23(32)33-18-3-1-2-14(10-18)12-28-29-21(30)13-27-22(31)15-4-7-17(26)8-5-15/h1-12H,13H2,(H,27,31)(H,29,30)
InChIKBENWZCFTRGUAKF-UHFFFAOYSA-N
TotalMolweight488.301
Molweight488.301
MonoisotopicMass487.050189
CLogP5.0286
CLogS-6.744
H Acceptors7
H Donors2
TotalSurfaceArea354.66
Relative PSA0.23558
PolarSurfaceArea96.86
Druglikeness3.7616
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantlow
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.66667
Fragments1
Non HAtoms33
NonCHAtoms10
Electronegative Atoms10
Rotatable Bond8
Rings Closures3
Small Rings3
Aromatic Rings3
Aromatic Atoms18
Sp3Atoms2
Symmetricatoms2
Amides1
StereoCon

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