2-[2-(benzenesulfonyl)ethylsulfanyl]-N-[(Z)-thiophen-3-ylmethylideneamino]acetamide

Formula:C15H16N2O3S3 Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[2-(benzenesulfonyl)ethylsulfanyl]-N-[(Z)-thiophen-3-ylmethylideneamino]acetamide is a drug-like molecule.

MolName2-[2-(benzenesulfonyl)ethylsulfanyl]-N-[(Z)-thiophen-3-ylmethylideneamino]acetamide
MolecularFormulaC15H16N2O3S3
SmilesO=C(CSCCS(c1ccccc1)(=O)=O)N/N=C\c1cscc1
InChIInChI=1S/C15H16N2O3S3/c18-15(17-16-10-13-6-7-21-11-13)12-22-8-9-23(19,20)14-4-2-1-3-5-14/h1-7,10-11H,8-9,12H2,(H,17,18)
InChIKOKYVDWCBMFIZFX-UHFFFAOYSA-N
TotalMolweight368.501
Molweight368.501
MonoisotopicMass368.032303
CLogP2.3698
CLogS-4.339
H Acceptors5
H Donors1
TotalSurfaceArea270.28
Relative PSA0.37901
PolarSurfaceArea137.52
Druglikeness-12.015
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.69565
Fragments1
Non HAtoms23
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond8
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms11
Sp3Atoms5
Symmetricatoms3
StereoCon

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