Chemryt - We contribute to the Chemicals, Pharmaceutical & Biotech industry using information technology

C22H25N3O7S | Cheminformatics

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

Molecular Formula : C22H25N3O7S | Mutagenic : none | Tumorigenic : none | Reproductive Effective : none |
(5Z)-5-[[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]methylidene]-3-(2-morpholin-4-yl-2-oxoethyl)-1,3-thiazolidine-2,4-dione is a drug-like molecule.

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

MolecularFormula : C22H25N3O7S

Smiles : O=C(CN(C(/C(/S1)=C/c(cc2)ccc2OCC(N2CCOCC2)=O)=O)C1=O)N1CCOCC1

InChI : InChI=1S/C22H25N3O7S/c26-19(23-5-9-30-10-6-23)14-25-21(28)18(33-22(25)29)13-16-1-3-17(4-2-16)32-15-20(27)24-7-11-31-12-8-24/h1-4,13H,5-12,14-15H2

InChIK : RAQKGSHLUUIDBJ-UHFFFAOYSA-N

TotalMolweight : 475.521

Molweight : 475.521

MonoisotopicMass : 475.141322

CLogP : 0.3107

CLogS : -1.749

H Acceptors : 10

TotalSurfaceArea : 344.46

Relative PSA : 0.32021

PolarSurfaceArea : 130.99

Druglikeness : 4.5097

Mutagenic : none

Tumorigenic : none

Reproductive Effective : none

Irritant : none

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

Shape Index : 0.63636

Fragments : 1

Non HAtoms : 33

NonCHAtoms : 11

Electronegative Atoms : 11

Rotatable Bond : 6

Rings Closures : 4

Small Rings : 4

Aromatic Rings : 1

Aromatic Atoms : 6

Sp3Atoms : 14

Symmetricatoms : 6

Amides : 3

StereoCon :

Request More Details | (5Z)-5-[[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]methylidene]-3-(2-morpholin-4-yl-2-oxoethyl)-1,3-thiazolidine-2,4-dione


SKU Product Name Product Unit Qty Supplier Email
User Name
User Email
Additional Comments