2-[(5Z)-5-[(2,6-dichlorophenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]-N-pyridin-3-ylacetamide

Formula:C17H11N3O3Cl2S Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[(5Z)-5-[(2,6-dichlorophenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]-N-pyridin-3-ylacetamide is a drug-like molecule.

MolName	2-[(5Z)-5-[(2,6-dichlorophenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]-N-pyridin-3-ylacetamide
MolecularFormula	C17H11N3O3Cl2S
Smiles	O=C(CN(C(/C(/S1)=C/c(c(Cl)ccc2)c2Cl)=O)C1=O)Nc1cnccc1
InChI	InChI=1S/C17H11Cl2N3O3S/c18-12-4-1-5-13(19)11(12)7-14-16(24)22(17(25)26-14)9-15(23)21-10-3-2-6-20-8-10/h1-8H,9H2,(H,21,23)
InChIK	AAVUMDQFLRREFB-UHFFFAOYSA-N
TotalMolweight	408.264
Molweight	408.264
MonoisotopicMass	406.989816
CLogP	2.7458
CLogS	-4.738
H Acceptors	6
H Donors	1
TotalSurfaceArea	280.09
Relative PSA	0.29487
PolarSurfaceArea	104.67
Druglikeness	5.2133
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	limit! methylene-thiazolidine-2,4-dione
Shape Index	0.57692
Fragments	1
Non HAtoms	26
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	4
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	2
Symmetricatoms	3
Amides	2
Aromatic Nitrogens	1
StereoCon

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1 - 2-[(5Z)-5-[(2,6-dichlorophenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]-N-pyridin-3-ylacetamide | 2 - 2-[(5Z)-5-[(2,6-dichlorophenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]-N-pyridin-3-ylacetamide

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