N-[(Z)-(2-fluorophenyl)methylideneamino]-3-[3-[(2Z)-2-[(2-fluorophenyl)methylidene]hydrazinyl]-3-oxopropyl]sulfanylpropanamide

Formula:C20H20N4O2F2S Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-(2-fluorophenyl)methylideneamino]-3-[3-[(2Z)-2-[(2-fluorophenyl)methylidene]hydrazinyl]-3-oxopropyl]sulfanylpropanamide is a drug-like molecule.

MolNameN-[(Z)-(2-fluorophenyl)methylideneamino]-3-[3-[(2Z)-2-[(2-fluorophenyl)methylidene]hydrazinyl]-3-oxopropyl]sulfanylpropanamide
MolecularFormulaC20H20N4O2F2S
SmilesO=C(CCSCCC(N/N=C\c(cccc1)c1F)=O)N/N=C\c(cccc1)c1F
InChIInChI=1S/C20H20F2N4O2S/c21-17-7-3-1-5-15(17)13-23-25-19(27)9-11-29-12-10-20(28)26-24-14-16-6-2-4-8-18(16)22/h1-8,13-14H,9-12H2,(H,25,27)(H,26,28)
InChIKJKCOZIOLZLVWSD-UHFFFAOYSA-N
TotalMolweight418.467
Molweight418.467
MonoisotopicMass418.127502
CLogP4.295
CLogS-5.893
H Acceptors6
H Donors2
TotalSurfaceArea326.19
Relative PSA0.27441
PolarSurfaceArea108.22
Druglikeness3.0193
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.72414
Fragments1
Non HAtoms29
NonCHAtoms9
Electronegative Atoms9
Rotatable Bond10
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms5
Symmetricatoms14
StereoCon

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