4-[(2,2-diphenylacetyl)amino]-N-[(Z)-pyridin-3-ylmethylideneamino]benzamide

Formula:C27H22N4O2 Mutagenic:none Tumorigenic:none Reproductive Effective:none 4-[(2,2-diphenylacetyl)amino]-N-[(Z)-pyridin-3-ylmethylideneamino]benzamide is a drug-like molecule.

MolName4-[(2,2-diphenylacetyl)amino]-N-[(Z)-pyridin-3-ylmethylideneamino]benzamide
MolecularFormulaC27H22N4O2
SmilesO=C(C(c1ccccc1)c1ccccc1)Nc(cc1)ccc1C(N/N=C\c1cnccc1)=O
InChIInChI=1S/C27H22N4O2/c32-26(31-29-19-20-8-7-17-28-18-20)23-13-15-24(16-14-23)30-27(33)25(21-9-3-1-4-10-21)22-11-5-2-6-12-22/h1-19,25H,(H,30,33)(H,31,32)
InChIKWOALSWYXEIKQDA-UHFFFAOYSA-N
TotalMolweight434.498
Molweight434.498
MonoisotopicMass434.174276
CLogP4.8739
CLogS-5.552
H Acceptors6
H Donors2
TotalSurfaceArea346.98
Relative PSA0.20601
PolarSurfaceArea83.45
Druglikeness5.9211
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.57576
Fragments1
Non HAtoms33
NonCHAtoms6
Electronegative Atoms6
Rotatable Bond7
Rings Closures4
Small Rings4
Aromatic Rings4
Aromatic Atoms24
Sp3Atoms1
Symmetricatoms10
Amides1
Aromatic Nitrogens1
StereoCon

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