2-(1,1-dioxo-1,4-thiazinan-4-yl)-N-[(Z)-thiophen-2-ylmethylideneamino]acetamide

Formula:C11H15N3O3S2 Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-(1,1-dioxo-1,4-thiazinan-4-yl)-N-[(Z)-thiophen-2-ylmethylideneamino]acetamide is a drug-like molecule.

MolName2-(1,1-dioxo-1,4-thiazinan-4-yl)-N-[(Z)-thiophen-2-ylmethylideneamino]acetamide
MolecularFormulaC11H15N3O3S2
SmilesO=C(CN(CC1)CCS1(=O)=O)N/N=C\c1cccs1
InChIInChI=1S/C11H15N3O3S2/c15-11(13-12-8-10-2-1-5-18-10)9-14-3-6-19(16,17)7-4-14/h1-2,5,8H,3-4,6-7,9H2,(H,13,15)
InChIKXZGZVUJVUITRCG-UHFFFAOYSA-N
TotalMolweight301.39
Molweight301.39
MonoisotopicMass301.055482
CLogP0.2009
CLogS-1.88
H Acceptors6
H Donors1
TotalSurfaceArea217.35
Relative PSA0.40718
PolarSurfaceArea115.46
Druglikeness4.6446
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.68421
Fragments1
Non HAtoms19
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond4
Rings Closures2
Small Rings2
Aromatic Rings1
Aromatic Atoms5
Sp3Atoms7
Symmetricatoms3
Amines1
AlkylAmines1
BasicNitrogens1
StereoCon

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