4-[5-[(Z)-(4-amino-2-oxo-1,3-thiazol-5-ylidene)methyl]furan-2-yl]benzenesulfonamide

Formula:C14H11N3O4S2 Mutagenic:high Tumorigenic:high Reproductive Effective:none 4-[5-[(Z)-(4-amino-2-oxo-1,3-thiazol-5-ylidene)methyl]furan-2-yl]benzenesulfonamide is a drug-like molecule.

MolName4-[5-[(Z)-(4-amino-2-oxo-1,3-thiazol-5-ylidene)methyl]furan-2-yl]benzenesulfonamide
MolecularFormulaC14H11N3O4S2
SmilesNC(/C(/S1)=C/c2ccc(-c(cc3)ccc3S(N)(=O)=O)o2)=NC1=O
InChIInChI=1S/C14H11N3O4S2/c15-13-12(22-14(18)17-13)7-9-3-6-11(21-9)8-1-4-10(5-2-8)23(16,19)20/h1-7H,(H2,15,17,18)(H2,16,19,20)
InChIKPNJDREPOLHQNRM-UHFFFAOYSA-N
TotalMolweight349.39
Molweight349.39
MonoisotopicMass349.019097
CLogP0.7009
CLogS-4.648
H Acceptors7
H Donors2
TotalSurfaceArea237.75
Relative PSA0.48484
PolarSurfaceArea162.43
Druglikeness4.3141
Mutagenichigh
Tumorigenichigh
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.6087
Fragments1
Non HAtoms23
NonCHAtoms9
Electronegative Atoms9
Rotatable Bond3
Rings Closures3
Small Rings3
Aromatic Rings2
Aromatic Atoms11
Sp3Atoms2
Symmetricatoms3
Amides1
BasicNitrogens1
StereoCon

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