5-bromo-3-phenylimidazo[2,1-b][1,3]thiazole

C11H7BrN2S — CID 165493348

IUPAC5-bromo-3-phenylimidazo[2,1-b][1,3]thiazole
SMILESBrc1cnc2scc(-c3ccccc3)n12
InChIInChI=1S/C11H7BrN2S/c12-10-6-13-11-14(10)9(7-15-11)8-4-2-1-3-5-8/h1-7H
InChIKeyIPNALJZRZDPQKW-UHFFFAOYSA-N
MW279.16 g/mol
LogP3.83
Rot. Bonds1

About 5-bromo-3-phenylimidazo[2,1-b][1,3]thiazole

5-bromo-3-phenylimidazo[2,1-b][1,3]thiazole (PubChem CID 165493348) has the molecular formula C11H7BrN2S and a molecular weight of 279.16 g/mol. Its IUPAC name is 5-bromo-3-phenylimidazo[2,1-b][1,3]thiazole.

Molecular Properties

Compound Name5-bromo-3-phenylimidazo[2,1-b][1,3]thiazole
PubChem CID165493348
Molecular FormulaC11H7BrN2S
Molecular Weight279.16 g/mol
Exact Mass277.95
IUPAC Name5-bromo-3-phenylimidazo[2,1-b][1,3]thiazole
SMILESBrc1cnc2scc(-c3ccccc3)n12
InChIInChI=1S/C11H7BrN2S/c12-10-6-13-11-14(10)9(7-15-11)8-4-2-1-3-5-8/h1-7H
InChIKeyIPNALJZRZDPQKW-UHFFFAOYSA-N
XLogP3.83
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.16
LogP ≤ 53.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-bromo-3-phenylimidazo[2,1-b][1,3]thiazole?
The IUPAC name of 5-bromo-3-phenylimidazo[2,1-b][1,3]thiazole (CID 165493348) is 5-bromo-3-phenylimidazo[2,1-b][1,3]thiazole.
What is the SMILES notation for 5-bromo-3-phenylimidazo[2,1-b][1,3]thiazole?
The canonical SMILES for 5-bromo-3-phenylimidazo[2,1-b][1,3]thiazole is Brc1cnc2scc(-c3ccccc3)n12.
What is the InChIKey of 5-bromo-3-phenylimidazo[2,1-b][1,3]thiazole?
The InChIKey is IPNALJZRZDPQKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7BrN2S/c12-10-6-13-11-14(10)9(7-15-11)8-4-2-1-3-5-8/h1-7H.
What are the key properties of 5-bromo-3-phenylimidazo[2,1-b][1,3]thiazole?
5-bromo-3-phenylimidazo[2,1-b][1,3]thiazole has a molecular weight of 279.16 g/mol, XLogP of 3.83, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-3-phenylimidazo[2,1-b][1,3]thiazole is sourced from PubChem (CID 165493348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).