6-(4-fluorophenyl)-5-[(E)-2-pyrimidin-4-ylethenyl]imidazo[2,1-b][1,3]thiazole

C17H11FN4S — CID 141094501

IUPAC6-(4-fluorophenyl)-5-[(E)-2-pyrimidin-4-ylethenyl]imidazo[2,1-b][1,3]thiazole
SMILESFc1ccc(-c2nc3sccn3c2/C=C/c2ccncn2)cc1
InChIInChI=1S/C17H11FN4S/c18-13-3-1-12(2-4-13)16-15(22-9-10-23-17(22)21-16)6-5-14-7-8-19-11-20-14/h1-11H/b6-5+
InChIKeyLKFSWFSQFSEPMO-AATRIKPKSA-N
MW322.37 g/mol
LogP4.16
Rot. Bonds3

About 6-(4-fluorophenyl)-5-[(E)-2-pyrimidin-4-ylethenyl]imidazo[2,1-b][1,3]thiazole

6-(4-fluorophenyl)-5-[(E)-2-pyrimidin-4-ylethenyl]imidazo[2,1-b][1,3]thiazole (PubChem CID 141094501) has the molecular formula C17H11FN4S and a molecular weight of 322.37 g/mol. Its IUPAC name is 6-(4-fluorophenyl)-5-[(E)-2-pyrimidin-4-ylethenyl]imidazo[2,1-b][1,3]thiazole.

Molecular Properties

Compound Name6-(4-fluorophenyl)-5-[(E)-2-pyrimidin-4-ylethenyl]imidazo[2,1-b][1,3]thiazole
PubChem CID141094501
Molecular FormulaC17H11FN4S
Molecular Weight322.37 g/mol
Exact Mass322.07
IUPAC Name6-(4-fluorophenyl)-5-[(E)-2-pyrimidin-4-ylethenyl]imidazo[2,1-b][1,3]thiazole
SMILESFc1ccc(-c2nc3sccn3c2/C=C/c2ccncn2)cc1
InChIInChI=1S/C17H11FN4S/c18-13-3-1-12(2-4-13)16-15(22-9-10-23-17(22)21-16)6-5-14-7-8-19-11-20-14/h1-11H/b6-5+
InChIKeyLKFSWFSQFSEPMO-AATRIKPKSA-N
XLogP4.16
TPSA43.08 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.37
LogP ≤ 54.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 6-(4-fluorophenyl)-5-[(E)-2-pyrimidin-4-ylethenyl]imidazo[2,1-b][1,3]thiazole with MolForge

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Related Compounds

6-(4-Fluorophenyl)-2,3-dihydro-5-(4-pyridinyl)imidazo(2,1-b)thiazole
CID 5228
3-{Imidazo[2,1-b][1,3]thiazol-6-yl}aniline
CID 3312672
[4-(6-Methyl-imidazo[2,1-b]thiazol-5-yl)-thiazol-2-yl]-(4-methyl-pyridin-2-yl)-amine
CID 644740
Imidazopyridine 10e
CID 5329344
Imidazopyridine 10f
CID 5329345
4-[6-(4-Fluorophenyl)-2-[(4-methylpiperazin-1-yl)methyl]imidazo[2,1-b][1,3]thiazol-5-yl]pyrimidin-2-amine
CID 44579300
[1,3]Thiazolo[3,2-a]benzimidazole
CID 658562
4-(2-methylimidazo[1,2-a]pyrimidin-3-yl)-N-phenyl-1,3-thiazol-2-amine
CID 697303
6-(3-Chlorophenyl)-2-methylimidazo(2,1-b)(1,3)thiazole
CID 868206
Pifithrin-Beta
CID 443278
6-(4-Fluorophenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazole
CID 19022684
5,7-dimethyl-2-((1-methyl-4-phenyl-1H-imidazol-2-ylthio)methyl)imidazo[1,2-a]pyrimidine
CID 44548780

Frequently Asked Questions

What is the IUPAC name of 6-(4-fluorophenyl)-5-[(E)-2-pyrimidin-4-ylethenyl]imidazo[2,1-b][1,3]thiazole?
The IUPAC name of 6-(4-fluorophenyl)-5-[(E)-2-pyrimidin-4-ylethenyl]imidazo[2,1-b][1,3]thiazole (CID 141094501) is 6-(4-fluorophenyl)-5-[(E)-2-pyrimidin-4-ylethenyl]imidazo[2,1-b][1,3]thiazole.
What is the SMILES notation for 6-(4-fluorophenyl)-5-[(E)-2-pyrimidin-4-ylethenyl]imidazo[2,1-b][1,3]thiazole?
The canonical SMILES for 6-(4-fluorophenyl)-5-[(E)-2-pyrimidin-4-ylethenyl]imidazo[2,1-b][1,3]thiazole is Fc1ccc(-c2nc3sccn3c2/C=C/c2ccncn2)cc1.
What is the InChIKey of 6-(4-fluorophenyl)-5-[(E)-2-pyrimidin-4-ylethenyl]imidazo[2,1-b][1,3]thiazole?
The InChIKey is LKFSWFSQFSEPMO-AATRIKPKSA-N. The full InChI is InChI=1S/C17H11FN4S/c18-13-3-1-12(2-4-13)16-15(22-9-10-23-17(22)21-16)6-5-14-7-8-19-11-20-14/h1-11H/b6-5+.
What are the key properties of 6-(4-fluorophenyl)-5-[(E)-2-pyrimidin-4-ylethenyl]imidazo[2,1-b][1,3]thiazole?
6-(4-fluorophenyl)-5-[(E)-2-pyrimidin-4-ylethenyl]imidazo[2,1-b][1,3]thiazole has a molecular weight of 322.37 g/mol, XLogP of 4.16, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-fluorophenyl)-5-[(E)-2-pyrimidin-4-ylethenyl]imidazo[2,1-b][1,3]thiazole is sourced from PubChem (CID 141094501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).