4-[5-[(E)-2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-cyanoethenyl]furan-2-yl]benzenesulfonamide

Formula:C22H14N3O3ClS2 Mutagenic:high Tumorigenic:high Reproductive Effective:none 4-[5-[(E)-2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-cyanoethenyl]furan-2-yl]benzenesulfonamide is a drug-like molecule.

MolName	4-[5-[(E)-2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-cyanoethenyl]furan-2-yl]benzenesulfonamide
MolecularFormula	C22H14N3O3ClS2
Smiles	NS(c(cc1)ccc1-c1ccc(/C=C(/c2nc(-c(cc3)ccc3Cl)cs2)\C#N)o1)(=O)=O
InChI	InChI=1S/C22H14ClN3O3S2/c23-17-5-1-14(2-6-17)20-13-30-22(26-20)16(12-24)11-18-7-10-21(29-18)15-3-8-19(9-4-15)31(25,27)28/h1-11,13H,(H2,25,27,28)
InChIK	BZDOMXQUXKLTOU-UHFFFAOYSA-N
TotalMolweight	467.956
Molweight	467.956
MonoisotopicMass	467.016509
CLogP	4.2218
CLogS	-6.532
H Acceptors	6
H Donors	1
TotalSurfaceArea	335.87
Relative PSA	0.30622
PolarSurfaceArea	146.6
Druglikeness	1.6558
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.6129
Fragments	1
Non HAtoms	31
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	5
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	22
Sp3Atoms	1
Symmetricatoms	5
Amides	1
Aromatic Nitrogens	1
StereoCon

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