N,N'-bis[(Z)-(5-bromothiophen-2-yl)methylideneamino]pentanediamide

Formula:C15H14N4O2Br2S2 Mutagenic:none Tumorigenic:none Reproductive Effective:none N,N'-bis[(Z)-(5-bromothiophen-2-yl)methylideneamino]pentanediamide is not a drug-like molecule.

MolNameN,N'-bis[(Z)-(5-bromothiophen-2-yl)methylideneamino]pentanediamide
MolecularFormulaC15H14N4O2Br2S2
SmilesO=C(CCCC(N/N=C\c(s1)ccc1Br)=O)N/N=C\c(s1)ccc1Br
InChIInChI=1S/C15H14Br2N4O2S2/c16-12-6-4-10(24-12)8-18-20-14(22)2-1-3-15(23)21-19-9-11-5-7-13(17)25-11/h4-9H,1-3H2,(H,20,22)(H,21,23)
InChIKKMPPHQYZQHUIKI-UHFFFAOYSA-N
TotalMolweight506.242
Molweight506.242
MonoisotopicMass503.892488
CLogP5.4946
CLogS-6.65
H Acceptors6
H Donors2
TotalSurfaceArea311.38
Relative PSA0.36207
PolarSurfaceArea139.4
Druglikeness-3.3401
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.76
Fragments1
Non HAtoms25
NonCHAtoms10
Electronegative Atoms10
Rotatable Bond8
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms10
Sp3Atoms3
Symmetricatoms12
StereoCon

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