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C24H24N2O5S | Cheminformatics

(5Z)-3-(2-morpholin-4-yl-2-oxoethyl)-5-[[4-(2-phenylethoxy)phenyl]methylidene]-1,3-thiazolidine-2,4-dione

Molecular Formula : C24H24N2O5S | Mutagenic : none | Tumorigenic : none | Reproductive Effective : none |
(5Z)-3-(2-morpholin-4-yl-2-oxoethyl)-5-[[4-(2-phenylethoxy)phenyl]methylidene]-1,3-thiazolidine-2,4-dione is a drug-like molecule.

MolName : (5Z)-3-(2-morpholin-4-yl-2-oxoethyl)-5-[[4-(2-phenylethoxy)phenyl]methylidene]-1,3-thiazolidine-2,4-dione

MolecularFormula : C24H24N2O5S

Smiles : O=C(CN(C(/C(/S1)=C/c(cc2)ccc2OCCc2ccccc2)=O)C1=O)N1CCOCC1

InChI : InChI=1S/C24H24N2O5S/c27-22(25-11-14-30-15-12-25)17-26-23(28)21(32-24(26)29)16-19-6-8-20(9-7-19)31-13-10-18-4-2-1-3-5-18/h1-9,16H,10-15,17H2

InChIK : MMEVKYNXNBXRFJ-UHFFFAOYSA-N

TotalMolweight : 452.53

Molweight : 452.53

MonoisotopicMass : 452.140593

CLogP : 2.8397

CLogS : -3.712

H Acceptors : 7

TotalSurfaceArea : 338.39

Relative PSA : 0.24738

PolarSurfaceArea : 101.45

Druglikeness : 4.1138

Mutagenic : none

Tumorigenic : none

Reproductive Effective : none

Irritant : none

Nasty Functions : limit! methylene-thiazolidine-2,4-dione

Shape Index : 0.65625

Fragments : 1

Non HAtoms : 32

NonCHAtoms : 8

Electronegative Atoms : 8

Rotatable Bond : 7

Rings Closures : 4

Small Rings : 4

Aromatic Rings : 2

Aromatic Atoms : 12

Sp3Atoms : 10

Symmetricatoms : 6

Amides : 2

StereoCon :

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