4-[5-[(Z)-(2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl]benzenesulfonamide

Formula:C14H10N2O5S2 Mutagenic:high Tumorigenic:high Reproductive Effective:none 4-[5-[(Z)-(2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl]benzenesulfonamide is a drug-like molecule.

MolName4-[5-[(Z)-(2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl]benzenesulfonamide
MolecularFormulaC14H10N2O5S2
SmilesNS(c(cc1)ccc1-c1ccc(/C=C(/C(N2)=O)\SC2=O)o1)(=O)=O
InChIInChI=1S/C14H10N2O5S2/c15-23(19,20)10-4-1-8(2-5-10)11-6-3-9(21-11)7-12-13(17)16-14(18)22-12/h1-7H,(H2,15,19,20)(H,16,17,18)
InChIKJNPRTUHVCHGFHJ-UHFFFAOYSA-N
TotalMolweight350.374
Molweight350.374
MonoisotopicMass350.003113
CLogP1.1923
CLogS-4.508
H Acceptors7
H Donors2
TotalSurfaceArea235.47
Relative PSA0.47985
PolarSurfaceArea153.15
Druglikeness5.5807
Mutagenichigh
Tumorigenichigh
Reproductive Effectivenone
Irritantnone
Nasty Functionslimit! methylene-thiazolidine-2,4-dione
Shape Index0.6087
Fragments1
Non HAtoms23
NonCHAtoms9
Electronegative Atoms9
Rotatable Bond3
Rings Closures3
Small Rings3
Aromatic Rings2
Aromatic Atoms11
Sp3Atoms2
Symmetricatoms3
Amides2
StereoCon

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