N-[(E)-3-oxo-3-[(2Z)-2-[(E)-3-phenylprop-2-enylidene]hydrazinyl]-1-thiophen-2-ylprop-1-en-2-yl]benzamide

Formula:C23H19N3O2S Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(E)-3-oxo-3-[(2Z)-2-[(E)-3-phenylprop-2-enylidene]hydrazinyl]-1-thiophen-2-ylprop-1-en-2-yl]benzamide is a drug-like molecule.

MolName	N-[(E)-3-oxo-3-[(2Z)-2-[(E)-3-phenylprop-2-enylidene]hydrazinyl]-1-thiophen-2-ylprop-1-en-2-yl]benzamide
MolecularFormula	C23H19N3O2S
Smiles	O=C(/C(/NC(c1ccccc1)=O)=C\c1cccs1)N/N=C\C=C\c1ccccc1
InChI	InChI=1S/C23H19N3O2S/c27-22(19-12-5-2-6-13-19)25-21(17-20-14-8-16-29-20)23(28)26-24-15-7-11-18-9-3-1-4-10-18/h1-17H,(H,25,27)(H,26,28)
InChIK	HUJFZTFDQCBSKL-UHFFFAOYSA-N
TotalMolweight	401.489
Molweight	401.489
MonoisotopicMass	401.119797
CLogP	4.7032
CLogS	-5.768
H Acceptors	5
H Donors	2
TotalSurfaceArea	323.11
Relative PSA	0.25029
PolarSurfaceArea	98.8
Druglikeness	7.5888
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.58621
Fragments	1
Non HAtoms	29
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	7
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Symmetricatoms	4
Amides	1
StereoCon

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