N-(2-chlorophenyl)-4-oxo-4-[2-[(E)-3-thiophen-2-ylprop-2-enoyl]hydrazinyl]butanamide

Formula:C17H16N3O3ClS Mutagenic:none Tumorigenic:none Reproductive Effective:none N-(2-chlorophenyl)-4-oxo-4-[2-[(E)-3-thiophen-2-ylprop-2-enoyl]hydrazinyl]butanamide is a drug-like molecule.

MolName	N-(2-chlorophenyl)-4-oxo-4-[2-[(E)-3-thiophen-2-ylprop-2-enoyl]hydrazinyl]butanamide
MolecularFormula	C17H16N3O3ClS
Smiles	O=C(CCC(NNC(/C=C/c1cccs1)=O)=O)Nc(cccc1)c1Cl
InChI	InChI=1S/C17H16ClN3O3S/c18-13-5-1-2-6-14(13)19-15(22)9-10-17(24)21-20-16(23)8-7-12-4-3-11-25-12/h1-8,11H,9-10H2,(H,19,22)(H,20,23)(H,21,24)
InChIK	QHYXMDNMNIITAL-UHFFFAOYSA-N
TotalMolweight	377.851
Molweight	377.851
MonoisotopicMass	377.060089
CLogP	2.2705
CLogS	-4.77
H Acceptors	6
H Donors	3
TotalSurfaceArea	286.03
Relative PSA	0.32815
PolarSurfaceArea	115.54
Druglikeness	1.9508
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	low
Nasty Functions
Shape Index	0.68
Fragments	1
Non HAtoms	25
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	7
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	2
Amides	1
StereoCon

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1 - N-(2-chlorophenyl)-4-oxo-4-[2-[(E)-3-thiophen-2-ylprop-2-enoyl]hydrazinyl]butanamide | 2 - N-(2-chlorophenyl)-4-oxo-4-[2-[(E)-3-thiophen-2-ylprop-2-enoyl]hydrazinyl]butanamide

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