3-chloro-N-[(Z)-[5-(2,4-dichlorophenyl)-1-phenylpyrazin-2-ylidene]amino]benzamide

Formula:C23H15N4OCl3 Mutagenic:none Tumorigenic:none Reproductive Effective:low 3-chloro-N-[(Z)-[5-(2,4-dichlorophenyl)-1-phenylpyrazin-2-ylidene]amino]benzamide is not a drug-like molecule.

MolName3-chloro-N-[(Z)-[5-(2,4-dichlorophenyl)-1-phenylpyrazin-2-ylidene]amino]benzamide
MolecularFormulaC23H15N4OCl3
SmilesO=C(c1cc(Cl)ccc1)N/N=C(/C=NC(c(ccc(Cl)c1)c1Cl)=C1)\N1c1ccccc1
InChIInChI=1S/C23H15Cl3N4O/c24-16-6-4-5-15(11-16)23(31)29-28-22-13-27-21(19-10-9-17(25)12-20(19)26)14-30(22)18-7-2-1-3-8-18/h1-14H,(H,29,31)
InChIKQRVYZJWUEWWABL-UHFFFAOYSA-N
TotalMolweight469.758
Molweight469.758
MonoisotopicMass468.031142
CLogP5.8657
CLogS-7.595
H Acceptors5
H Donors1
TotalSurfaceArea337.49
Relative PSA0.15132
PolarSurfaceArea57.06
Druglikeness4.578
Mutagenicnone
Tumorigenicnone
Reproductive Effectivelow
Irritantnone
Nasty Functionsacyl-hydrazone
Shape Index0.51613
Fragments1
Non HAtoms31
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond4
Rings Closures4
Small Rings4
Aromatic Rings3
Aromatic Atoms18
Symmetricatoms2
StereoCon

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