3-(2,6-dichlorophenyl)-N-[(Z)-(2,6-dichlorophenyl)methylideneamino]-1,2,4-oxadiazole-5-carboxamide

Formula:C16H8N4O2Cl4 Mutagenic:none Tumorigenic:none Reproductive Effective:low 3-(2,6-dichlorophenyl)-N-[(Z)-(2,6-dichlorophenyl)methylideneamino]-1,2,4-oxadiazole-5-carboxamide is not a drug-like molecule.

MolName3-(2,6-dichlorophenyl)-N-[(Z)-(2,6-dichlorophenyl)methylideneamino]-1,2,4-oxadiazole-5-carboxamide
MolecularFormulaC16H8N4O2Cl4
SmilesO=C(c1nc(-c(c(Cl)ccc2)c2Cl)no1)N/N=C\c(c(Cl)ccc1)c1Cl
InChIInChI=1S/C16H8Cl4N4O2/c17-9-3-1-4-10(18)8(9)7-21-23-15(25)16-22-14(24-26-16)13-11(19)5-2-6-12(13)20/h1-7H,(H,23,25)
InChIKJHOAMHJQSVTQFF-UHFFFAOYSA-N
TotalMolweight430.078
Molweight430.078
MonoisotopicMass427.940134
CLogP5.4447
CLogS-7.568
H Acceptors6
H Donors1
TotalSurfaceArea295.64
Relative PSA0.24374
PolarSurfaceArea80.38
Druglikeness6.0545
Mutagenicnone
Tumorigenicnone
Reproductive Effectivelow
Irritantnone
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.57692
Fragments1
Non HAtoms26
NonCHAtoms10
Electronegative Atoms10
Rotatable Bond4
Rings Closures3
Small Rings3
Aromatic Rings3
Aromatic Atoms17
Symmetricatoms6
Aromatic Nitrogens2
StereoCon

Request More Details | 3-(2,6-dichlorophenyl)-N-[(Z)-(2,6-dichlorophenyl)methylideneamino]-1,2,4-oxadiazole-5-carboxamide


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