N-[2-[(5Z)-5-benzylidene-2,4-dioxo-1,3-thiazolidin-3-yl]ethyl]-2-chloro-4,5-difluorobenzamide

Formula:C19H13N2O3ClF2S Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[2-[(5Z)-5-benzylidene-2,4-dioxo-1,3-thiazolidin-3-yl]ethyl]-2-chloro-4,5-difluorobenzamide is a drug-like molecule.

MolName	N-[2-[(5Z)-5-benzylidene-2,4-dioxo-1,3-thiazolidin-3-yl]ethyl]-2-chloro-4,5-difluorobenzamide
MolecularFormula	C19H13N2O3ClF2S
Smiles	O=C(c(cc(c(F)c1)F)c1Cl)NCCN(C(/C(/S1)=C/c2ccccc2)=O)C1=O
InChI	InChI=1S/C19H13ClF2N2O3S/c20-13-10-15(22)14(21)9-12(13)17(25)23-6-7-24-18(26)16(28-19(24)27)8-11-4-2-1-3-5-11/h1-5,8-10H,6-7H2,(H,23,25)
InChIK	UHYADCQLIDQSMB-UHFFFAOYSA-N
TotalMolweight	422.838
Molweight	422.838
MonoisotopicMass	422.030346
CLogP	3.4837
CLogS	-5.388
H Acceptors	5
H Donors	1
TotalSurfaceArea	292.37
Relative PSA	0.24496
PolarSurfaceArea	91.78
Druglikeness	4.4253
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	limit! methylene-thiazolidine-2,4-dione; polyhalo aromatic ring
Shape Index	0.60714
Fragments	1
Non HAtoms	28
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	3
Symmetricatoms	2
Amides	2
StereoCon

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1 - N-[2-[(5Z)-5-benzylidene-2,4-dioxo-1,3-thiazolidin-3-yl]ethyl]-2-chloro-4,5-difluorobenzamide | 2 - N-[2-[(5Z)-5-benzylidene-2,4-dioxo-1,3-thiazolidin-3-yl]ethyl]-2-chloro-4,5-difluorobenzamide

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