(E)-N-benzyl-2-(2-oxopyridin-1-yl)-3-phenyl-N-(2-phenylethyl)prop-2-enamide

Formula:C29H26N2O2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-N-benzyl-2-(2-oxopyridin-1-yl)-3-phenyl-N-(2-phenylethyl)prop-2-enamide is not a drug-like molecule.

MolName(E)-N-benzyl-2-(2-oxopyridin-1-yl)-3-phenyl-N-(2-phenylethyl)prop-2-enamide
MolecularFormulaC29H26N2O2
SmilesO=C(/C(/N(C=CC=C1)C1=O)=C\c1ccccc1)N(CCc1ccccc1)Cc1ccccc1
InChIInChI=1S/C29H26N2O2/c32-28-18-10-11-20-31(28)27(22-25-14-6-2-7-15-25)29(33)30(23-26-16-8-3-9-17-26)21-19-24-12-4-1-5-13-24/h1-18,20,22H,19,21,23H2
InChIKZUZQKSAJRTZYGI-UHFFFAOYSA-N
TotalMolweight434.537
Molweight434.537
MonoisotopicMass434.199428
CLogP5.0378
CLogS-4.882
H Acceptors4
TotalSurfaceArea354.37
Relative PSA0.093631
PolarSurfaceArea40.62
Druglikeness3.4212
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.42424
Fragments1
Non HAtoms33
NonCHAtoms4
Electronegative Atoms4
Rotatable Bond8
Rings Closures4
Small Rings4
Aromatic Rings3
Aromatic Atoms18
Sp3Atoms3
Symmetricatoms6
Amides2
StereoCon

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