2-(2-chloroanilino)-N-[(Z)-[4-[(Z)-[[2-(2-chloroanilino)acetyl]hydrazinylidene]methyl]phenyl]methylideneamino]acetamide

Formula:C24H22N6O2Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-(2-chloroanilino)-N-[(Z)-[4-[(Z)-[[2-(2-chloroanilino)acetyl]hydrazinylidene]methyl]phenyl]methylideneamino]acetamide is a drug-like molecule.

MolName2-(2-chloroanilino)-N-[(Z)-[4-[(Z)-[[2-(2-chloroanilino)acetyl]hydrazinylidene]methyl]phenyl]methylideneamino]acetamide
MolecularFormulaC24H22N6O2Cl2
SmilesO=C(CNc(cccc1)c1Cl)N/N=C\c1ccc(/C=N\NC(CNc(cccc2)c2Cl)=O)cc1
InChIInChI=1S/C24H22Cl2N6O2/c25-19-5-1-3-7-21(19)27-15-23(33)31-29-13-17-9-11-18(12-10-17)14-30-32-24(34)16-28-22-8-4-2-6-20(22)26/h1-14,27-28H,15-16H2,(H,31,33)(H,32,34)
InChIKSBBDLNPYZNTXEK-UHFFFAOYSA-N
TotalMolweight497.385
Molweight497.385
MonoisotopicMass496.118128
CLogP4.5394
CLogS-6.942
H Acceptors8
H Donors4
TotalSurfaceArea382
Relative PSA0.24853
PolarSurfaceArea106.98
Druglikeness5.0457
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.70588
Fragments1
Non HAtoms34
NonCHAtoms10
Electronegative Atoms10
Rotatable Bond10
Rings Closures3
Small Rings3
Aromatic Rings3
Aromatic Atoms18
Sp3Atoms2
Symmetricatoms18
Amines2
Aromatic Amines2
StereoCon

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