4-bromo-1,3-thiazol-2-ol;cadmium

C3H2BrCdNOS — CID 168951383

IUPAC4-bromo-1,3-thiazol-2-ol;cadmium
SMILESOc1nc(Br)cs1.[Cd]
InChIInChI=1S/C3H2BrNOS.Cd/c4-2-1-7-3(6)5-2;/h1H,(H,5,6);
InChIKeyHXTRVXRUUYLNKG-UHFFFAOYSA-N
MW292.44 g/mol
LogP1.61
Rot. Bonds

About 4-bromo-1,3-thiazol-2-ol;cadmium

4-bromo-1,3-thiazol-2-ol;cadmium (PubChem CID 168951383) has the molecular formula C3H2BrCdNOS and a molecular weight of 292.44 g/mol. Its IUPAC name is 4-bromo-1,3-thiazol-2-ol;cadmium.

Molecular Properties

Compound Name4-bromo-1,3-thiazol-2-ol;cadmium
PubChem CID168951383
Molecular FormulaC3H2BrCdNOS
Molecular Weight292.44 g/mol
Exact Mass292.81
IUPAC Name4-bromo-1,3-thiazol-2-ol;cadmium
SMILESOc1nc(Br)cs1.[Cd]
InChIInChI=1S/C3H2BrNOS.Cd/c4-2-1-7-3(6)5-2;/h1H,(H,5,6);
InChIKeyHXTRVXRUUYLNKG-UHFFFAOYSA-N
XLogP1.61
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.44
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-bromo-1,3-thiazol-2-ol;cadmium?
The IUPAC name of 4-bromo-1,3-thiazol-2-ol;cadmium (CID 168951383) is 4-bromo-1,3-thiazol-2-ol;cadmium.
What is the SMILES notation for 4-bromo-1,3-thiazol-2-ol;cadmium?
The canonical SMILES for 4-bromo-1,3-thiazol-2-ol;cadmium is Oc1nc(Br)cs1.[Cd].
What is the InChIKey of 4-bromo-1,3-thiazol-2-ol;cadmium?
The InChIKey is HXTRVXRUUYLNKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H2BrNOS.Cd/c4-2-1-7-3(6)5-2;/h1H,(H,5,6);.
What are the key properties of 4-bromo-1,3-thiazol-2-ol;cadmium?
4-bromo-1,3-thiazol-2-ol;cadmium has a molecular weight of 292.44 g/mol, XLogP of 1.61, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-1,3-thiazol-2-ol;cadmium is sourced from PubChem (CID 168951383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).