5-bromo-2-(5-chlorofuran-2-yl)-1,3-thiazole

C7H3BrClNOS — CID 117259089

IUPAC5-bromo-2-(5-chlorofuran-2-yl)-1,3-thiazole
SMILESClc1ccc(-c2ncc(Br)s2)o1
InChIInChI=1S/C7H3BrClNOS/c8-5-3-10-7(12-5)4-1-2-6(9)11-4/h1-3H
InChIKeyZNHPRQWBSFQFPD-UHFFFAOYSA-N
MW264.53 g/mol
LogP3.82
Rot. Bonds1

About 5-bromo-2-(5-chlorofuran-2-yl)-1,3-thiazole

5-bromo-2-(5-chlorofuran-2-yl)-1,3-thiazole (PubChem CID 117259089) has the molecular formula C7H3BrClNOS and a molecular weight of 264.53 g/mol. Its IUPAC name is 5-bromo-2-(5-chlorofuran-2-yl)-1,3-thiazole.

Molecular Properties

Compound Name5-bromo-2-(5-chlorofuran-2-yl)-1,3-thiazole
PubChem CID117259089
Molecular FormulaC7H3BrClNOS
Molecular Weight264.53 g/mol
Exact Mass262.88
IUPAC Name5-bromo-2-(5-chlorofuran-2-yl)-1,3-thiazole
SMILESClc1ccc(-c2ncc(Br)s2)o1
InChIInChI=1S/C7H3BrClNOS/c8-5-3-10-7(12-5)4-1-2-6(9)11-4/h1-3H
InChIKeyZNHPRQWBSFQFPD-UHFFFAOYSA-N
XLogP3.82
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.53
LogP ≤ 53.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-(5-chlorofuran-2-yl)-1,3-thiazole?
The IUPAC name of 5-bromo-2-(5-chlorofuran-2-yl)-1,3-thiazole (CID 117259089) is 5-bromo-2-(5-chlorofuran-2-yl)-1,3-thiazole.
What is the SMILES notation for 5-bromo-2-(5-chlorofuran-2-yl)-1,3-thiazole?
The canonical SMILES for 5-bromo-2-(5-chlorofuran-2-yl)-1,3-thiazole is Clc1ccc(-c2ncc(Br)s2)o1.
What is the InChIKey of 5-bromo-2-(5-chlorofuran-2-yl)-1,3-thiazole?
The InChIKey is ZNHPRQWBSFQFPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H3BrClNOS/c8-5-3-10-7(12-5)4-1-2-6(9)11-4/h1-3H.
What are the key properties of 5-bromo-2-(5-chlorofuran-2-yl)-1,3-thiazole?
5-bromo-2-(5-chlorofuran-2-yl)-1,3-thiazole has a molecular weight of 264.53 g/mol, XLogP of 3.82, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-(5-chlorofuran-2-yl)-1,3-thiazole is sourced from PubChem (CID 117259089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).