1-N',4-N'-bis[(E)-(2-oxonaphthalen-1-ylidene)methyl]benzene-1,4-dicarbohydrazide

Formula:C30H22N4O4 Mutagenic:none Tumorigenic:low Reproductive Effective:low 1-N',4-N'-bis[(E)-(2-oxonaphthalen-1-ylidene)methyl]benzene-1,4-dicarbohydrazide is not a drug-like molecule.

MolName1-N',4-N'-bis[(E)-(2-oxonaphthalen-1-ylidene)methyl]benzene-1,4-dicarbohydrazide
MolecularFormulaC30H22N4O4
SmilesO=C(c(cc1)ccc1C(NN/C=C(\c(cccc1)c1C=C1)/C1=O)=O)NN/C=C(\c(cccc1)c1C=C1)/C1=O
InChIInChI=1S/C30H22N4O4/c35-27-15-13-19-5-1-3-7-23(19)25(27)17-31-33-29(37)21-9-11-22(12-10-21)30(38)34-32-18-26-24-8-4-2-6-20(24)14-16-28(26)36/h1-18,31-32H,(H,33,37)(H,34,38)
InChIKQAGQUIOWAPHBPT-UHFFFAOYSA-N
TotalMolweight502.529
Molweight502.529
MonoisotopicMass502.164106
CLogP1.1848
CLogS-6.354
H Acceptors8
H Donors4
TotalSurfaceArea385.04
Relative PSA0.25452
PolarSurfaceArea116.4
Druglikeness3.4729
Mutagenicnone
Tumorigeniclow
Reproductive Effectivelow
Irritantnone
Nasty Functions
Shape Index0.57895
Fragments1
Non HAtoms38
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond6
Rings Closures5
Small Rings5
Aromatic Rings3
Aromatic Atoms18
Symmetricatoms20
StereoCon

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