N-[(5Z)-5-(2H-chromen-3-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-2-hydroxybenzamide

Formula:C20H14N2O4S2 Mutagenic:none Tumorigenic:none Reproductive Effective:high N-[(5Z)-5-(2H-chromen-3-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-2-hydroxybenzamide is a drug-like molecule.

MolNameN-[(5Z)-5-(2H-chromen-3-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-2-hydroxybenzamide
MolecularFormulaC20H14N2O4S2
SmilesOc(cccc1)c1C(NN(C(/C(/S1)=C/C2=Cc(cccc3)c3OC2)=O)C1=S)=O
InChIInChI=1S/C20H14N2O4S2/c23-15-7-3-2-6-14(15)18(24)21-22-19(25)17(28-20(22)27)10-12-9-13-5-1-4-8-16(13)26-11-12/h1-10,23H,11H2,(H,21,24)
InChIKRYJUOJYWPGJMKS-UHFFFAOYSA-N
TotalMolweight410.473
Molweight410.473
MonoisotopicMass410.039498
CLogP1.5357
CLogS-4.688
H Acceptors6
H Donors2
TotalSurfaceArea293.01
Relative PSA0.37432
PolarSurfaceArea136.26
Druglikeness3.9159
Mutagenicnone
Tumorigenicnone
Reproductive Effectivehigh
Irritantnone
Nasty Functions
Shape Index0.57143
Fragments1
Non HAtoms28
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond3
Rings Closures4
Small Rings4
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms5
StereoCon

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