(4Z)-4-[(Z)-(3-carboxy-1-phenylpropylidene)hydrazinylidene]-4-phenylbutanoic acid

Formula:C20H20N2O4 Mutagenic:none Tumorigenic:none Reproductive Effective:none (4Z)-4-[(Z)-(3-carboxy-1-phenylpropylidene)hydrazinylidene]-4-phenylbutanoic acid is a drug-like molecule.

MolName(4Z)-4-[(Z)-(3-carboxy-1-phenylpropylidene)hydrazinylidene]-4-phenylbutanoic acid
MolecularFormulaC20H20N2O4
SmilesOC(CC/C(/c1ccccc1)=N/N=C(/CCC(O)=O)\c1ccccc1)=O
InChIInChI=1S/C20H20N2O4/c23-19(24)13-11-17(15-7-3-1-4-8-15)21-22-18(12-14-20(25)26)16-9-5-2-6-10-16/h1-10H,11-14H2,(H,23,24)(H,25,26)
InChIKAXCOIWORIPCYRY-UHFFFAOYSA-N
TotalMolweight352.389
Molweight352.389
MonoisotopicMass352.142308
CLogP3.9264
CLogS-4.882
H Acceptors6
H Donors2
TotalSurfaceArea282.2
Relative PSA0.26683
PolarSurfaceArea99.32
Druglikeness-0.60703
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsdimethylene-hydrazine
Shape Index0.46154
Fragments1
Non HAtoms26
NonCHAtoms6
Electronegative Atoms6
Rotatable Bond9
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms6
Symmetricatoms15
AcidicOxygens2
StereoCon

Request More Details | (4Z)-4-[(Z)-(3-carboxy-1-phenylpropylidene)hydrazinylidene]-4-phenylbutanoic acid


SKU Product Name Product Unit Qty Supplier Email
User Name
User Email
Additional Comments