N,N'-bis[(Z)-(2,4-difluorophenyl)methylideneamino]hexanediamide

Formula:C20H18N4O2F4 Mutagenic:none Tumorigenic:none Reproductive Effective:none N,N'-bis[(Z)-(2,4-difluorophenyl)methylideneamino]hexanediamide is a drug-like molecule.

MolNameN,N'-bis[(Z)-(2,4-difluorophenyl)methylideneamino]hexanediamide
MolecularFormulaC20H18N4O2F4
SmilesO=C(CCCCC(N/N=C\c(ccc(F)c1)c1F)=O)N/N=C\c(ccc(F)c1)c1F
InChIInChI=1S/C20H18F4N4O2/c21-15-7-5-13(17(23)9-15)11-25-27-19(29)3-1-2-4-20(30)28-26-12-14-6-8-16(22)10-18(14)24/h5-12H,1-4H2,(H,27,29)(H,28,30)
InChIKLAWYQZXGVDQQEU-UHFFFAOYSA-N
TotalMolweight422.381
Molweight422.381
MonoisotopicMass422.136588
CLogP4.7592
CLogS-6.454
H Acceptors6
H Donors2
TotalSurfaceArea321.4
Relative PSA0.22408
PolarSurfaceArea82.92
Druglikeness-5.4695
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.73333
Fragments1
Non HAtoms30
NonCHAtoms10
Electronegative Atoms10
Rotatable Bond9
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms4
Symmetricatoms15
StereoCon

Request More Details | N,N'-bis[(Z)-(2,4-difluorophenyl)methylideneamino]hexanediamide


SKU Product Name Product Unit Qty Supplier Email
User Name
User Email
Additional Comments