N,N'-bis[(Z)-naphthalen-1-ylmethylideneamino]hexanediamide

Formula:C28H26N4O2 Mutagenic:none Tumorigenic:high Reproductive Effective:none N,N'-bis[(Z)-naphthalen-1-ylmethylideneamino]hexanediamide is not a drug-like molecule.

MolNameN,N'-bis[(Z)-naphthalen-1-ylmethylideneamino]hexanediamide
MolecularFormulaC28H26N4O2
SmilesO=C(CCCCC(N/N=C\c1cccc2ccccc12)=O)N/N=C\c1cccc2ccccc12
InChIInChI=1S/C28H26N4O2/c33-27(31-29-19-23-13-7-11-21-9-1-3-15-25(21)23)17-5-6-18-28(34)32-30-20-24-14-8-12-22-10-2-4-16-26(22)24/h1-4,7-16,19-20H,5-6,17-18H2,(H,31,33)(H,32,34)
InChIKGXIKXKFOBBSRLO-UHFFFAOYSA-N
TotalMolweight450.54
Molweight450.54
MonoisotopicMass450.205576
CLogP6.7448
CLogS-8.41
H Acceptors6
H Donors2
TotalSurfaceArea365.2
Relative PSA0.19721
PolarSurfaceArea82.92
Druglikeness-4.1295
Mutagenicnone
Tumorigenichigh
Reproductive Effectivenone
Irritantnone
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.64706
Fragments1
Non HAtoms34
NonCHAtoms6
Electronegative Atoms6
Rotatable Bond9
Rings Closures4
Small Rings4
Aromatic Rings4
Aromatic Atoms20
Sp3Atoms4
Symmetricatoms17
StereoCon

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