6-phenyl-5-pyrimidin-4-ylimidazo[2,1-b][1,3]thiazole

C15H10N4S — CID 58541804

IUPAC6-phenyl-5-pyrimidin-4-ylimidazo[2,1-b][1,3]thiazole
SMILESc1ccc(-c2nc3sccn3c2-c2ccncn2)cc1
InChIInChI=1S/C15H10N4S/c1-2-4-11(5-3-1)13-14(12-6-7-16-10-17-12)19-8-9-20-15(19)18-13/h1-10H
InChIKeyHSJVHCBABYQGEZ-UHFFFAOYSA-N
MW278.34 g/mol
LogP3.52
Rot. Bonds2

About 6-phenyl-5-pyrimidin-4-ylimidazo[2,1-b][1,3]thiazole

6-phenyl-5-pyrimidin-4-ylimidazo[2,1-b][1,3]thiazole (PubChem CID 58541804) has the molecular formula C15H10N4S and a molecular weight of 278.34 g/mol. Its IUPAC name is 6-phenyl-5-pyrimidin-4-ylimidazo[2,1-b][1,3]thiazole.

Molecular Properties

Compound Name6-phenyl-5-pyrimidin-4-ylimidazo[2,1-b][1,3]thiazole
PubChem CID58541804
Molecular FormulaC15H10N4S
Molecular Weight278.34 g/mol
Exact Mass278.06
IUPAC Name6-phenyl-5-pyrimidin-4-ylimidazo[2,1-b][1,3]thiazole
SMILESc1ccc(-c2nc3sccn3c2-c2ccncn2)cc1
InChIInChI=1S/C15H10N4S/c1-2-4-11(5-3-1)13-14(12-6-7-16-10-17-12)19-8-9-20-15(19)18-13/h1-10H
InChIKeyHSJVHCBABYQGEZ-UHFFFAOYSA-N
XLogP3.52
TPSA43.08 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.34
LogP ≤ 53.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-phenyl-5-pyrimidin-4-ylimidazo[2,1-b][1,3]thiazole?
The IUPAC name of 6-phenyl-5-pyrimidin-4-ylimidazo[2,1-b][1,3]thiazole (CID 58541804) is 6-phenyl-5-pyrimidin-4-ylimidazo[2,1-b][1,3]thiazole.
What is the SMILES notation for 6-phenyl-5-pyrimidin-4-ylimidazo[2,1-b][1,3]thiazole?
The canonical SMILES for 6-phenyl-5-pyrimidin-4-ylimidazo[2,1-b][1,3]thiazole is c1ccc(-c2nc3sccn3c2-c2ccncn2)cc1.
What is the InChIKey of 6-phenyl-5-pyrimidin-4-ylimidazo[2,1-b][1,3]thiazole?
The InChIKey is HSJVHCBABYQGEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10N4S/c1-2-4-11(5-3-1)13-14(12-6-7-16-10-17-12)19-8-9-20-15(19)18-13/h1-10H.
What are the key properties of 6-phenyl-5-pyrimidin-4-ylimidazo[2,1-b][1,3]thiazole?
6-phenyl-5-pyrimidin-4-ylimidazo[2,1-b][1,3]thiazole has a molecular weight of 278.34 g/mol, XLogP of 3.52, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-phenyl-5-pyrimidin-4-ylimidazo[2,1-b][1,3]thiazole is sourced from PubChem (CID 58541804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).