2-[2-oxo-2-[(2Z)-2-(thiophen-2-ylmethylidene)hydrazinyl]ethoxy]-N-[(Z)-thiophen-2-ylmethylideneamino]acetamide

Formula:C14H14N4O3S2 Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[2-oxo-2-[(2Z)-2-(thiophen-2-ylmethylidene)hydrazinyl]ethoxy]-N-[(Z)-thiophen-2-ylmethylideneamino]acetamide is a drug-like molecule.

MolName2-[2-oxo-2-[(2Z)-2-(thiophen-2-ylmethylidene)hydrazinyl]ethoxy]-N-[(Z)-thiophen-2-ylmethylideneamino]acetamide
MolecularFormulaC14H14N4O3S2
SmilesO=C(COCC(N/N=C\c1cccs1)=O)N/N=C\c1cccs1
InChIInChI=1S/C14H14N4O3S2/c19-13(17-15-7-11-3-1-5-22-11)9-21-10-14(20)18-16-8-12-4-2-6-23-12/h1-8H,9-10H2,(H,17,19)(H,18,20)
InChIKYIVDPJBVBNYJQU-UHFFFAOYSA-N
TotalMolweight350.422
Molweight350.422
MonoisotopicMass350.050731
CLogP2.1791
CLogS-4.059
H Acceptors7
H Donors2
TotalSurfaceArea270.36
Relative PSA0.45399
PolarSurfaceArea148.63
Druglikeness4.2347
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.73913
Fragments1
Non HAtoms23
NonCHAtoms9
Electronegative Atoms9
Rotatable Bond8
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms10
Sp3Atoms3
Symmetricatoms11
StereoCon

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