4-pyridin-2-yl-1,2,4-dithiazolidine-3,5-dione

C7H4N2O2S2 — CID 163929369

IUPAC4-pyridin-2-yl-1,2,4-dithiazolidine-3,5-dione
SMILESO=c1ssc(=O)n1-c1ccccn1
InChIInChI=1S/C7H4N2O2S2/c10-6-9(7(11)13-12-6)5-3-1-2-4-8-5/h1-4H
InChIKeyRHJYYCLXRKKRAU-UHFFFAOYSA-N
MW212.26 g/mol
LogP0.72
Rot. Bonds1

About 4-pyridin-2-yl-1,2,4-dithiazolidine-3,5-dione

4-pyridin-2-yl-1,2,4-dithiazolidine-3,5-dione (PubChem CID 163929369) has the molecular formula C7H4N2O2S2 and a molecular weight of 212.26 g/mol. Its IUPAC name is 4-pyridin-2-yl-1,2,4-dithiazolidine-3,5-dione.

Molecular Properties

Compound Name4-pyridin-2-yl-1,2,4-dithiazolidine-3,5-dione
PubChem CID163929369
Molecular FormulaC7H4N2O2S2
Molecular Weight212.26 g/mol
Exact Mass211.97
IUPAC Name4-pyridin-2-yl-1,2,4-dithiazolidine-3,5-dione
SMILESO=c1ssc(=O)n1-c1ccccn1
InChIInChI=1S/C7H4N2O2S2/c10-6-9(7(11)13-12-6)5-3-1-2-4-8-5/h1-4H
InChIKeyRHJYYCLXRKKRAU-UHFFFAOYSA-N
XLogP0.72
TPSA51.96 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.26
LogP ≤ 50.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 4-pyridin-2-yl-1,2,4-dithiazolidine-3,5-dione with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4,8-dibromo-2,6-dipyridin-2-ylpyrrolo[3,4-f]isoindole-1,3,5,7-tetrone
CID 23823306
2-pyridin-2-yl-1,2-thiazol-3-one
CID 44564009
3-pyridin-2-yl-1H-1,3,5-triazine-2,4-dione
CID 175968865
4,6-diphenyl-1-pyridin-2-ylpyridin-2-one
CID 629641
5-chloro-1-pyridin-2-ylpyrrole-2-carbaldehyde
CID 87180422
6-cyclopentyl-1-pyridin-2-ylpyridin-2-one
CID 178081600
2-pyridin-2-yl-1H-pyrazol-5-one
CID 11457847
2-[2,5-bis[(4-fluorophenyl)sulfanyl]pyrrol-1-yl]pyridine
CID 149347269
1-ethoxy-3-pyridin-2-ylbenzimidazol-2-one
CID 22922573
6-cyclohexyl-1-pyridin-2-ylpyridin-2-one
CID 178081614
1-pyridin-2-yl-3,7-dihydropurine-2,6-dione
CID 170328644
3-pyridin-2-yl-1H-imidazol-2-one
CID 130008445

Frequently Asked Questions

What is the IUPAC name of 4-pyridin-2-yl-1,2,4-dithiazolidine-3,5-dione?
The IUPAC name of 4-pyridin-2-yl-1,2,4-dithiazolidine-3,5-dione (CID 163929369) is 4-pyridin-2-yl-1,2,4-dithiazolidine-3,5-dione.
What is the SMILES notation for 4-pyridin-2-yl-1,2,4-dithiazolidine-3,5-dione?
The canonical SMILES for 4-pyridin-2-yl-1,2,4-dithiazolidine-3,5-dione is O=c1ssc(=O)n1-c1ccccn1.
What is the InChIKey of 4-pyridin-2-yl-1,2,4-dithiazolidine-3,5-dione?
The InChIKey is RHJYYCLXRKKRAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4N2O2S2/c10-6-9(7(11)13-12-6)5-3-1-2-4-8-5/h1-4H.
What are the key properties of 4-pyridin-2-yl-1,2,4-dithiazolidine-3,5-dione?
4-pyridin-2-yl-1,2,4-dithiazolidine-3,5-dione has a molecular weight of 212.26 g/mol, XLogP of 0.72, 1 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-pyridin-2-yl-1,2,4-dithiazolidine-3,5-dione is sourced from PubChem (CID 163929369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).