2-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]-N-[(Z)-naphthalen-1-ylmethylideneamino]acetamide

Formula:C24H25N4OCl Mutagenic:none Tumorigenic:high Reproductive Effective:none 2-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]-N-[(Z)-naphthalen-1-ylmethylideneamino]acetamide is a drug-like molecule.

MolName2-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]-N-[(Z)-naphthalen-1-ylmethylideneamino]acetamide
MolecularFormulaC24H25N4OCl
SmilesO=C(CN1CCN(Cc(cccc2)c2Cl)CC1)N/N=C\c1cccc2ccccc12
InChIInChI=1S/C24H25ClN4O/c25-23-11-4-2-7-21(23)17-28-12-14-29(15-13-28)18-24(30)27-26-16-20-9-5-8-19-6-1-3-10-22(19)20/h1-11,16H,12-15,17-18H2,(H,27,30)
InChIKBDEUDPVCYGBVCA-UHFFFAOYSA-N
TotalMolweight420.943
Molweight420.943
MonoisotopicMass420.171688
CLogP4.3482
CLogS-4.908
H Acceptors5
H Donors1
TotalSurfaceArea326.67
Relative PSA0.13197
PolarSurfaceArea47.94
Druglikeness9.295
Mutagenicnone
Tumorigenichigh
Reproductive Effectivenone
Irritantnone
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.63333
Fragments1
Non HAtoms30
NonCHAtoms6
Electronegative Atoms6
Rotatable Bond6
Rings Closures4
Small Rings4
Aromatic Rings3
Aromatic Atoms16
Sp3Atoms8
Symmetricatoms2
Amines2
AlkylAmines2
BasicNitrogens2
StereoCon

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