4-chloro-N-[3-[2-[(5Z)-5-[(4-chlorophenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]ethylamino]-3-oxopropyl]benzamide

Formula:C22H19N3O4Cl2S Mutagenic:none Tumorigenic:none Reproductive Effective:none 4-chloro-N-[3-[2-[(5Z)-5-[(4-chlorophenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]ethylamino]-3-oxopropyl]benzamide is a drug-like molecule.

MolName	4-chloro-N-[3-[2-[(5Z)-5-[(4-chlorophenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]ethylamino]-3-oxopropyl]benzamide
MolecularFormula	C22H19N3O4Cl2S
Smiles	O=C(CCNC(c(cc1)ccc1Cl)=O)NCCN(C(/C(/S1)=C/c(cc2)ccc2Cl)=O)C1=O
InChI	InChI=1S/C22H19Cl2N3O4S/c23-16-5-1-14(2-6-16)13-18-21(30)27(22(31)32-18)12-11-25-19(28)9-10-26-20(29)15-3-7-17(24)8-4-15/h1-8,13H,9-12H2,(H,25,28)(H,26,29)
InChIK	SOFWHOHSSHSCRE-UHFFFAOYSA-N
TotalMolweight	492.382
Molweight	492.382
MonoisotopicMass	491.047331
CLogP	3.4262
CLogS	-5.533
H Acceptors	7
H Donors	2
TotalSurfaceArea	351.82
Relative PSA	0.27321
PolarSurfaceArea	120.88
Druglikeness	6.03
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	limit! methylene-thiazolidine-2,4-dione
Shape Index	0.6875
Fragments	1
Non HAtoms	32
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	8
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	5
Symmetricatoms	4
Amides	3
StereoCon

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1 - 4-chloro-N-[3-[2-[(5Z)-5-[(4-chlorophenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]ethylamino]-3-oxopropyl]benzamide | 2 - 4-chloro-N-[3-[2-[(5Z)-5-[(4-chlorophenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]ethylamino]-3-oxopropyl]benzamide

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