N-[(Z)-(2,4-dichlorophenyl)methylideneamino]-1H-indole-2-carboxamide

Formula:C16H11N3OCl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-(2,4-dichlorophenyl)methylideneamino]-1H-indole-2-carboxamide is a drug-like molecule.

MolNameN-[(Z)-(2,4-dichlorophenyl)methylideneamino]-1H-indole-2-carboxamide
MolecularFormulaC16H11N3OCl2
SmilesO=C(c1cc(cccc2)c2[nH]1)N/N=C\c(ccc(Cl)c1)c1Cl
InChIInChI=1S/C16H11Cl2N3O/c17-12-6-5-11(13(18)8-12)9-19-21-16(22)15-7-10-3-1-2-4-14(10)20-15/h1-9,20H,(H,21,22)
InChIKJUODAEVZDAOLJA-UHFFFAOYSA-N
TotalMolweight332.189
Molweight332.189
MonoisotopicMass331.027916
CLogP4.507
CLogS-5.742
H Acceptors4
H Donors2
TotalSurfaceArea242
Relative PSA0.20661
PolarSurfaceArea57.25
Druglikeness5.6159
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.63636
Fragments1
Non HAtoms22
NonCHAtoms6
Electronegative Atoms6
Rotatable Bond3
Rings Closures3
Small Rings3
Aromatic Rings3
Aromatic Atoms15
Aromatic Nitrogens1
StereoCon

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