6-(2,5-difluorophenyl)-2-phenylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde

C18H10F2N2OS — CID 82367774

IUPAC6-(2,5-difluorophenyl)-2-phenylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde
SMILESO=Cc1c(-c2cc(F)ccc2F)nc2sc(-c3ccccc3)cn12
InChIInChI=1S/C18H10F2N2OS/c19-12-6-7-14(20)13(8-12)17-15(10-23)22-9-16(24-18(22)21-17)11-4-2-1-3-5-11/h1-10H
InChIKeyYHRICIRESDBASF-UHFFFAOYSA-N
MW340.35 g/mol
LogP4.82
Rot. Bonds3

About 6-(2,5-difluorophenyl)-2-phenylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde

6-(2,5-difluorophenyl)-2-phenylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde (PubChem CID 82367774) has the molecular formula C18H10F2N2OS and a molecular weight of 340.35 g/mol. Its IUPAC name is 6-(2,5-difluorophenyl)-2-phenylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde.

Molecular Properties

Compound Name6-(2,5-difluorophenyl)-2-phenylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde
PubChem CID82367774
Molecular FormulaC18H10F2N2OS
Molecular Weight340.35 g/mol
Exact Mass340.05
IUPAC Name6-(2,5-difluorophenyl)-2-phenylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde
SMILESO=Cc1c(-c2cc(F)ccc2F)nc2sc(-c3ccccc3)cn12
InChIInChI=1S/C18H10F2N2OS/c19-12-6-7-14(20)13(8-12)17-15(10-23)22-9-16(24-18(22)21-17)11-4-2-1-3-5-11/h1-10H
InChIKeyYHRICIRESDBASF-UHFFFAOYSA-N
XLogP4.82
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.35
LogP ≤ 54.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

Analyze 6-(2,5-difluorophenyl)-2-phenylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-(2,5-difluorophenyl)-2-phenylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde?
The IUPAC name of 6-(2,5-difluorophenyl)-2-phenylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde (CID 82367774) is 6-(2,5-difluorophenyl)-2-phenylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde.
What is the SMILES notation for 6-(2,5-difluorophenyl)-2-phenylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde?
The canonical SMILES for 6-(2,5-difluorophenyl)-2-phenylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde is O=Cc1c(-c2cc(F)ccc2F)nc2sc(-c3ccccc3)cn12.
What is the InChIKey of 6-(2,5-difluorophenyl)-2-phenylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde?
The InChIKey is YHRICIRESDBASF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H10F2N2OS/c19-12-6-7-14(20)13(8-12)17-15(10-23)22-9-16(24-18(22)21-17)11-4-2-1-3-5-11/h1-10H.
What are the key properties of 6-(2,5-difluorophenyl)-2-phenylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde?
6-(2,5-difluorophenyl)-2-phenylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde has a molecular weight of 340.35 g/mol, XLogP of 4.82, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,5-difluorophenyl)-2-phenylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde is sourced from PubChem (CID 82367774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).