N'-[(E)-[(E)-1,3-diphenylprop-2-enylidene]amino]-N-phenylbutanediamide

Formula:C25H23N3O2 Mutagenic:none Tumorigenic:none Reproductive Effective:none N'-[(E)-[(E)-1,3-diphenylprop-2-enylidene]amino]-N-phenylbutanediamide is a drug-like molecule.

MolNameN'-[(E)-[(E)-1,3-diphenylprop-2-enylidene]amino]-N-phenylbutanediamide
MolecularFormulaC25H23N3O2
SmilesO=C(CCC(N/N=C(\C=C\c1ccccc1)/c1ccccc1)=O)Nc1ccccc1
InChIInChI=1S/C25H23N3O2/c29-24(26-22-14-8-3-9-15-22)18-19-25(30)28-27-23(21-12-6-2-7-13-21)17-16-20-10-4-1-5-11-20/h1-17H,18-19H2,(H,26,29)(H,28,30)
InChIKUXZFYTRXPQDXGT-UHFFFAOYSA-N
TotalMolweight397.477
Molweight397.477
MonoisotopicMass397.179027
CLogP4.7636
CLogS-5.965
H Acceptors5
H Donors2
TotalSurfaceArea328.19
Relative PSA0.18437
PolarSurfaceArea70.56
Druglikeness2.7245
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsacyl-hydrazone
Shape Index0.6
Fragments1
Non HAtoms30
NonCHAtoms5
Electronegative Atoms5
Rotatable Bond8
Rings Closures3
Small Rings3
Aromatic Rings3
Aromatic Atoms18
Sp3Atoms2
Symmetricatoms6
Amides1
StereoCon

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