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

Formula:C19H14N2O3Cl2S Mutagenic:none Tumorigenic:high Reproductive Effective:high N-[2-[(5Z)-5-benzylidene-2,4-dioxo-1,3-thiazolidin-3-yl]ethyl]-2,5-dichlorobenzamide is a drug-like molecule.

MolName	N-[2-[(5Z)-5-benzylidene-2,4-dioxo-1,3-thiazolidin-3-yl]ethyl]-2,5-dichlorobenzamide
MolecularFormula	C19H14N2O3Cl2S
Smiles	O=C(c(cc(cc1)Cl)c1Cl)NCCN(C(/C(/S1)=C/c2ccccc2)=O)C1=O
InChI	InChI=1S/C19H14Cl2N2O3S/c20-13-6-7-15(21)14(11-13)17(24)22-8-9-23-18(25)16(27-19(23)26)10-12-4-2-1-3-5-12/h1-7,10-11H,8-9H2,(H,22,24)
InChIK	BKRNZIINWKSWHT-UHFFFAOYSA-N
TotalMolweight	421.303
Molweight	421.303
MonoisotopicMass	420.010217
CLogP	3.8881
CLogS	-5.496
H Acceptors	5
H Donors	1
TotalSurfaceArea	295.09
Relative PSA	0.24271
PolarSurfaceArea	91.78
Druglikeness	5.7653
Mutagenic	none
Tumorigenic	high
Reproductive Effective	high
Irritant	none
Nasty Functions	limit! methylene-thiazolidine-2,4-dione
Shape Index	0.59259
Fragments	1
Non HAtoms	27
NonCHAtoms	8
Electronegative Atoms	8
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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