2-[(2Z)-2-benzylidenehydrazinyl]-1,3-thiazole-4-carbohydrazide

Formula:C11H11N5OS Mutagenic:none Tumorigenic:high Reproductive Effective:none 2-[(2Z)-2-benzylidenehydrazinyl]-1,3-thiazole-4-carbohydrazide is a drug-like molecule.

MolName2-[(2Z)-2-benzylidenehydrazinyl]-1,3-thiazole-4-carbohydrazide
MolecularFormulaC11H11N5OS
SmilesNNC(c1csc(N/N=C\c2ccccc2)n1)=O
InChIInChI=1S/C11H11N5OS/c12-15-10(17)9-7-18-11(14-9)16-13-6-8-4-2-1-3-5-8/h1-7H,12H2,(H,14,16)(H,15,17)
InChIKXFICSPGSHLNFJN-UHFFFAOYSA-N
TotalMolweight261.308
Molweight261.308
MonoisotopicMass261.06843
CLogP2.8434
CLogS-3.272
H Acceptors6
H Donors3
TotalSurfaceArea201.67
Relative PSA0.46646
PolarSurfaceArea120.64
Druglikeness-0.84888
Mutagenicnone
Tumorigenichigh
Reproductive Effectivenone
Irritantnone
Nasty Functionshydrazine; imine/hydrazone of aldehyde
Shape Index0.72222
Fragments1
Non HAtoms18
NonCHAtoms7
Electronegative Atoms7
Rotatable Bond4
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms11
Sp3Atoms1
Symmetricatoms2
Aromatic Nitrogens1
BasicNitrogens1
StereoCon

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