3-(4-fluorophenyl)-5,6-diphenylimidazo[2,1-b][1,3]thiazole

C23H15FN2S — CID 4303796

IUPAC3-(4-fluorophenyl)-5,6-diphenylimidazo[2,1-b][1,3]thiazole
SMILESFc1ccc(-c2csc3nc(-c4ccccc4)c(-c4ccccc4)n23)cc1
InChIInChI=1S/C23H15FN2S/c24-19-13-11-16(12-14-19)20-15-27-23-25-21(17-7-3-1-4-8-17)22(26(20)23)18-9-5-2-6-10-18/h1-15H
InChIKeyIDSVOLYZIPIZID-UHFFFAOYSA-N
MW370.45 g/mol
LogP6.54
Rot. Bonds3

About 3-(4-fluorophenyl)-5,6-diphenylimidazo[2,1-b][1,3]thiazole

3-(4-fluorophenyl)-5,6-diphenylimidazo[2,1-b][1,3]thiazole (PubChem CID 4303796) has the molecular formula C23H15FN2S and a molecular weight of 370.45 g/mol. Its IUPAC name is 3-(4-fluorophenyl)-5,6-diphenylimidazo[2,1-b][1,3]thiazole.

Molecular Properties

Compound Name3-(4-fluorophenyl)-5,6-diphenylimidazo[2,1-b][1,3]thiazole
PubChem CID4303796
Molecular FormulaC23H15FN2S
Molecular Weight370.45 g/mol
Exact Mass370.09
IUPAC Name3-(4-fluorophenyl)-5,6-diphenylimidazo[2,1-b][1,3]thiazole
SMILESFc1ccc(-c2csc3nc(-c4ccccc4)c(-c4ccccc4)n23)cc1
InChIInChI=1S/C23H15FN2S/c24-19-13-11-16(12-14-19)20-15-27-23-25-21(17-7-3-1-4-8-17)22(26(20)23)18-9-5-2-6-10-18/h1-15H
InChIKeyIDSVOLYZIPIZID-UHFFFAOYSA-N
XLogP6.54
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500370.45
LogP ≤ 56.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenyl)-5,6-diphenylimidazo[2,1-b][1,3]thiazole?
The IUPAC name of 3-(4-fluorophenyl)-5,6-diphenylimidazo[2,1-b][1,3]thiazole (CID 4303796) is 3-(4-fluorophenyl)-5,6-diphenylimidazo[2,1-b][1,3]thiazole.
What is the SMILES notation for 3-(4-fluorophenyl)-5,6-diphenylimidazo[2,1-b][1,3]thiazole?
The canonical SMILES for 3-(4-fluorophenyl)-5,6-diphenylimidazo[2,1-b][1,3]thiazole is Fc1ccc(-c2csc3nc(-c4ccccc4)c(-c4ccccc4)n23)cc1.
What is the InChIKey of 3-(4-fluorophenyl)-5,6-diphenylimidazo[2,1-b][1,3]thiazole?
The InChIKey is IDSVOLYZIPIZID-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H15FN2S/c24-19-13-11-16(12-14-19)20-15-27-23-25-21(17-7-3-1-4-8-17)22(26(20)23)18-9-5-2-6-10-18/h1-15H.
What are the key properties of 3-(4-fluorophenyl)-5,6-diphenylimidazo[2,1-b][1,3]thiazole?
3-(4-fluorophenyl)-5,6-diphenylimidazo[2,1-b][1,3]thiazole has a molecular weight of 370.45 g/mol, XLogP of 6.54, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)-5,6-diphenylimidazo[2,1-b][1,3]thiazole is sourced from PubChem (CID 4303796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).