4-[5-[(Z)-2-cyano-2-(2,4-dichlorophenyl)ethenyl]furan-2-yl]benzenesulfonamide

Formula:C19H12N2O3Cl2S Mutagenic:high Tumorigenic:high Reproductive Effective:none 4-[5-[(Z)-2-cyano-2-(2,4-dichlorophenyl)ethenyl]furan-2-yl]benzenesulfonamide is a drug-like molecule.

MolName4-[5-[(Z)-2-cyano-2-(2,4-dichlorophenyl)ethenyl]furan-2-yl]benzenesulfonamide
MolecularFormulaC19H12N2O3Cl2S
SmilesNS(c(cc1)ccc1-c1ccc(/C=C(/c(ccc(Cl)c2)c2Cl)\C#N)o1)(=O)=O
InChIInChI=1S/C19H12Cl2N2O3S/c20-14-3-7-17(18(21)10-14)13(11-22)9-15-4-8-19(26-15)12-1-5-16(6-2-12)27(23,24)25/h1-10H,(H2,23,24,25)
InChIKCWHICALJYPWZHV-UHFFFAOYSA-N
TotalMolweight419.287
Molweight419.287
MonoisotopicMass417.994567
CLogP4.2475
CLogS-6.46
H Acceptors5
H Donors1
TotalSurfaceArea296.83
Relative PSA0.24095
PolarSurfaceArea105.47
Druglikeness0.18555
Mutagenichigh
Tumorigenichigh
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.59259
Fragments1
Non HAtoms27
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond4
Rings Closures3
Small Rings3
Aromatic Rings3
Aromatic Atoms17
Sp3Atoms1
Symmetricatoms3
Amides1
StereoCon

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