HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.8.0
  1. Home
  2. /Compound

4-Thiazolidinone, 3,3'-(1,2-ethanediyl)bis(2-(2-thienyl)-, 1,1,1',1'-tetroxide, (R*,R*)-(+-)-

HCID 3076480
New noteNew reactionRequest quotes
Print preview
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
131420-48-9
Standard SMILES
O=C1CS(=O)(=O)[C@@H](c2cccs2)N1CCN1C(=O)CS(=O)(=O)[C@H]1c1cccs1
InChIKey
QOBDLYKLEYOQGS-HOTGVXAUSA-N
Molecular formula
C16H16N2O6S4
Average molar mass
460.6 g/mol
Monoisotopic mass
459.98912093

Names & identifiers

Preferred name
4-Thiazolidinone, 3,3'-(1,2-ethanediyl)bis(2-(2-thienyl)-, 1,1,1',1'-tetroxide, (R*,R*)-(+-)-
IUPAC
(2S)-1,1-dioxo-2-thiophen-2-yl-3-[2-[(2S)-1,1,4-trioxo-2-thiophen-2-yl-1,3-thiazolidin-3-yl]ethyl]-1,3-thiazolidin-4-one

Names & synonyms

BRN 42407044-Thiazolidinone, 3,3'-(1,2-ethanediyl)bis(2-(2-thienyl)-, 1,1,1',1'-tetroxide, (R*,R*)-(+-)-131420-48-9(R*,R*)-(+-)-3,3'-(1,2-Ethanediyl)bis(2-(2-thienyl)-4-thiazolidinone) 1,1,1',1'-tetroxideDTXSID20157040RefChem:296583DTXCID7079531(2S,2'S)-3,3'-(Ethane-1,2-diyl)bis[2-(thiophen-2-yl)-1lambda~6~,3-thiazolidine-1,1,4-trione]

Database identifiers

CAS
131420-48-9
PubChem CID
3076480
DTXSID
DTXSID20157040

Properties

Computed structural properties

XLogP
0.3
Topological polar surface area
182 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
8
Rotatable bonds
5
Heavy atoms
28
Formal charge
0
Complexity
791

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes
More actions
New noteNew reactionRequest quotes