3-(1,3-thiazol-2-ylmethyl)imidazolidine-2,4-dione

C7H7N3O2S — CID 103935891

IUPAC3-(1,3-thiazol-2-ylmethyl)imidazolidine-2,4-dione
SMILESO=C1CNC(=O)N1Cc1nccs1
InChIInChI=1S/C7H7N3O2S/c11-6-3-9-7(12)10(6)4-5-8-1-2-13-5/h1-2H,3-4H2,(H,9,12)
InChIKeyLJZHKWHZCZTLLO-UHFFFAOYSA-N
MW197.22 g/mol
LogP0.19
Rot. Bonds2

About 3-(1,3-thiazol-2-ylmethyl)imidazolidine-2,4-dione

3-(1,3-thiazol-2-ylmethyl)imidazolidine-2,4-dione (PubChem CID 103935891) has the molecular formula C7H7N3O2S and a molecular weight of 197.22 g/mol. Its IUPAC name is 3-(1,3-thiazol-2-ylmethyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name3-(1,3-thiazol-2-ylmethyl)imidazolidine-2,4-dione
PubChem CID103935891
Molecular FormulaC7H7N3O2S
Molecular Weight197.22 g/mol
Exact Mass197.03
IUPAC Name3-(1,3-thiazol-2-ylmethyl)imidazolidine-2,4-dione
SMILESO=C1CNC(=O)N1Cc1nccs1
InChIInChI=1S/C7H7N3O2S/c11-6-3-9-7(12)10(6)4-5-8-1-2-13-5/h1-2H,3-4H2,(H,9,12)
InChIKeyLJZHKWHZCZTLLO-UHFFFAOYSA-N
XLogP0.19
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.22
LogP ≤ 50.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

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Related Compounds

5-Methyl-5-(1,3-thiazol-2-yl)imidazolidine-2,4-dione
CID 64990799
2-(2,4-dioxo(1,3-thiazolidin-3-yl))-N-(1,3-thiazol-2-yl)acetamide
CID 4737173
(1,3-Thiazol-2-ylmethyl)urea
CID 52176394
1-(2-Oxo-2-pyrrolidin-1-ylethyl)-3-[1-(1,3-thiazol-2-yl)propyl]urea
CID 72006421
5,5-dimethyl-3-[2-[[(2S)-2-(1,3-thiazol-2-yl)butan-2-yl]amino]ethyl]imidazolidine-2,4-dione
CID 95901346
3-[3-[[(2S)-2-(1,3-thiazol-2-yl)butan-2-yl]amino]propyl]imidazolidine-2,4-dione
CID 95901370
Thiazol-2-ylthiazolidin-4-one
CID 129761723
N-(2-aminoethyl)-1,3-thiazole-2-carboxamide
CID 13800283
3-Methyl-1-[(1,3-thiazol-2-yl)methyl]urea
CID 23548411
2-(methylamino)-N-(1,3-thiazol-2-ylmethyl)acetamide
CID 61285054
N-methyl-1,3-thiazole-2-carboxamide
CID 66606466
3-(1,3-Thiazol-2-yl)imidazolidine-2,4-dione
CID 67593779

Frequently Asked Questions

What is the IUPAC name of 3-(1,3-thiazol-2-ylmethyl)imidazolidine-2,4-dione?
The IUPAC name of 3-(1,3-thiazol-2-ylmethyl)imidazolidine-2,4-dione (CID 103935891) is 3-(1,3-thiazol-2-ylmethyl)imidazolidine-2,4-dione.
What is the SMILES notation for 3-(1,3-thiazol-2-ylmethyl)imidazolidine-2,4-dione?
The canonical SMILES for 3-(1,3-thiazol-2-ylmethyl)imidazolidine-2,4-dione is O=C1CNC(=O)N1Cc1nccs1.
What is the InChIKey of 3-(1,3-thiazol-2-ylmethyl)imidazolidine-2,4-dione?
The InChIKey is LJZHKWHZCZTLLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N3O2S/c11-6-3-9-7(12)10(6)4-5-8-1-2-13-5/h1-2H,3-4H2,(H,9,12).
What are the key properties of 3-(1,3-thiazol-2-ylmethyl)imidazolidine-2,4-dione?
3-(1,3-thiazol-2-ylmethyl)imidazolidine-2,4-dione has a molecular weight of 197.22 g/mol, XLogP of 0.19, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1,3-thiazol-2-ylmethyl)imidazolidine-2,4-dione is sourced from PubChem (CID 103935891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).