[3-[(Z)-[[2-[(3-fluorobenzoyl)amino]acetyl]hydrazinylidene]methyl]phenyl] 3-fluorobenzoate

Formula:C23H17N3O4F2 Mutagenic:none Tumorigenic:none Reproductive Effective:none [3-[(Z)-[[2-[(3-fluorobenzoyl)amino]acetyl]hydrazinylidene]methyl]phenyl] 3-fluorobenzoate is a drug-like molecule.

MolName[3-[(Z)-[[2-[(3-fluorobenzoyl)amino]acetyl]hydrazinylidene]methyl]phenyl] 3-fluorobenzoate
MolecularFormulaC23H17N3O4F2
SmilesO=C(CNC(c1cc(F)ccc1)=O)N/N=C\c1cccc(OC(c2cccc(F)c2)=O)c1
InChIInChI=1S/C23H17F2N3O4/c24-18-7-2-5-16(11-18)22(30)26-14-21(29)28-27-13-15-4-1-9-20(10-15)32-23(31)17-6-3-8-19(25)12-17/h1-13H,14H2,(H,26,30)(H,28,29)
InChIKDXURLBRBDJHOAX-UHFFFAOYSA-N
TotalMolweight437.401
Molweight437.401
MonoisotopicMass437.118713
CLogP3.9174
CLogS-5.586
H Acceptors7
H Donors2
TotalSurfaceArea330.17
Relative PSA0.25305
PolarSurfaceArea96.86
Druglikeness3.7131
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.625
Fragments1
Non HAtoms32
NonCHAtoms9
Electronegative Atoms9
Rotatable Bond8
Rings Closures3
Small Rings3
Aromatic Rings3
Aromatic Atoms18
Sp3Atoms2
Amides1
StereoCon

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