1,2,3-Trithiane

Details

Top
Internal ID 6cc71b9c-0754-4329-ba69-c1936c8f906f
Taxonomy Organoheterocyclic compounds > Trithianes
IUPAC Name trithiane
SMILES (Canonical) C1CSSSC1
SMILES (Isomeric) C1CSSSC1
InChI InChI=1S/C3H6S3/c1-2-4-6-5-3-1/h1-3H2
InChI Key BVOMRRWJQOJMPA-UHFFFAOYSA-N
Popularity 92 references in papers

Physical and Chemical Properties

Top
Molecular Formula C3H6S3
Molecular Weight 138.30 g/mol
Exact Mass 137.96316371 g/mol
Topological Polar Surface Area (TPSA) 75.90 Ų
XlogP 1.50

Synonyms

Top
trithiane
1,2,3-trithiacyclohexane
3325-33-5
1,2,3-Trithian
TYP41AL8SG
N-Trithiane, 8CI
V-TRITHIANE
UNII-TYP41AL8SG
SCHEMBL1041232
CHEBI:39194
There are more than 10 synonyms. If you wish to see them all click here.

2D Structure

Top
2D Structure of 1,2,3-Trithiane

3D Structure

Top

ADMET Properties (via admetSAR 2)

Top
Target Value Probability (raw) Probability (%)
No predicted properties yet!

Targets

Top

Proven Targets:

CHEMBL ID UniProt ID Name Min activity Assay type Source
No proven targets yet!

Predicted Targets (via Super-PRED):

CHEMBL ID UniProt ID Name Probability Model accuracy
No predicted targets yet!

Plants that contains it

Top
Below are displayed all the plants proven (via scientific papers) to contain this compound!
To see more specific details click the taxa you are interested in.
There are no matching plants.

Cross-Links

Top
PubChem 123186
LOTUS LTS0126663
wikiData Q27119769