6-(2,4-dichlorophenyl)-2-phenylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde

C18H10Cl2N2OS — CID 82367729

IUPAC6-(2,4-dichlorophenyl)-2-phenylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde
SMILESO=Cc1c(-c2ccc(Cl)cc2Cl)nc2sc(-c3ccccc3)cn12
InChIInChI=1S/C18H10Cl2N2OS/c19-12-6-7-13(14(20)8-12)17-15(10-23)22-9-16(24-18(22)21-17)11-4-2-1-3-5-11/h1-10H
InChIKeyJIXVXIBRRCRYFF-UHFFFAOYSA-N
MW373.26 g/mol
LogP5.85
Rot. Bonds3

About 6-(2,4-dichlorophenyl)-2-phenylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde

6-(2,4-dichlorophenyl)-2-phenylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde (PubChem CID 82367729) has the molecular formula C18H10Cl2N2OS and a molecular weight of 373.26 g/mol. Its IUPAC name is 6-(2,4-dichlorophenyl)-2-phenylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde.

Molecular Properties

Compound Name6-(2,4-dichlorophenyl)-2-phenylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde
PubChem CID82367729
Molecular FormulaC18H10Cl2N2OS
Molecular Weight373.26 g/mol
Exact Mass371.99
IUPAC Name6-(2,4-dichlorophenyl)-2-phenylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde
SMILESO=Cc1c(-c2ccc(Cl)cc2Cl)nc2sc(-c3ccccc3)cn12
InChIInChI=1S/C18H10Cl2N2OS/c19-12-6-7-13(14(20)8-12)17-15(10-23)22-9-16(24-18(22)21-17)11-4-2-1-3-5-11/h1-10H
InChIKeyJIXVXIBRRCRYFF-UHFFFAOYSA-N
XLogP5.85
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500373.26
LogP ≤ 55.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

6-(2,5-difluorophenyl)-2-phenylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde
CID 82367774
2-[4-(aminooxymethyl)phenyl]-6-phenylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde
CID 155280682
6-(1-methylbenzimidazol-5-yl)-2-phenylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde
CID 82367751
2-(2,4-dichlorophenyl)-6-methylimidazo[1,2-a]pyridine-3-carbaldehyde
CID 36688047
2-chloro-6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazole-5-carbaldehyde
CID 10709091
[6-(4-chlorophenyl)-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanamine
CID 82367605
3-(2,4-dichlorophenyl)-6-thiophen-2-ylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde
CID 39198748
2-[2-(2,4-dichlorophenyl)-4-phenyl-1,3-thiazol-5-yl]acetic acid
CID 159765786
2-phenyl-[1,3]thiazolo[3,2-a]benzimidazole
CID 4694439
2-bromo-4-(2,4-dichlorophenyl)-1,3-thiazole-5-carboxylic acid
CID 58094854
2,4-dichloro-1-phenylbenzene;methane;dihydrochloride
CID 175257985
1-cyclopentyl-3-(2,4-dichlorophenyl)pyrazole-4-carbaldehyde
CID 61267084

Frequently Asked Questions

What is the IUPAC name of 6-(2,4-dichlorophenyl)-2-phenylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde?
The IUPAC name of 6-(2,4-dichlorophenyl)-2-phenylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde (CID 82367729) is 6-(2,4-dichlorophenyl)-2-phenylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde.
What is the SMILES notation for 6-(2,4-dichlorophenyl)-2-phenylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde?
The canonical SMILES for 6-(2,4-dichlorophenyl)-2-phenylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde is O=Cc1c(-c2ccc(Cl)cc2Cl)nc2sc(-c3ccccc3)cn12.
What is the InChIKey of 6-(2,4-dichlorophenyl)-2-phenylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde?
The InChIKey is JIXVXIBRRCRYFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H10Cl2N2OS/c19-12-6-7-13(14(20)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-(2,4-dichlorophenyl)-2-phenylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde?
6-(2,4-dichlorophenyl)-2-phenylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde has a molecular weight of 373.26 g/mol, XLogP of 5.85, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,4-dichlorophenyl)-2-phenylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde is sourced from PubChem (CID 82367729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).