2-(4-naphthalen-2-ylphenyl)imidazo[2,1-b][1,3]benzothiazole

C25H16N2S — CID 11712228

IUPAC2-(4-naphthalen-2-ylphenyl)imidazo[2,1-b][1,3]benzothiazole
SMILESc1ccc2cc(-c3ccc(-c4cn5c(n4)sc4ccccc45)cc3)ccc2c1
InChIInChI=1S/C25H16N2S/c1-2-6-20-15-21(14-11-17(20)5-1)18-9-12-19(13-10-18)22-16-27-23-7-3-4-8-24(23)28-25(27)26-22/h1-16H
InChIKeyBBYZTCUEWXBKGG-UHFFFAOYSA-N
MW376.48 g/mol
LogP7.04
Rot. Bonds2

About 2-(4-naphthalen-2-ylphenyl)imidazo[2,1-b][1,3]benzothiazole

2-(4-naphthalen-2-ylphenyl)imidazo[2,1-b][1,3]benzothiazole (PubChem CID 11712228) has the molecular formula C25H16N2S and a molecular weight of 376.48 g/mol. Its IUPAC name is 2-(4-naphthalen-2-ylphenyl)imidazo[2,1-b][1,3]benzothiazole.

Molecular Properties

Compound Name2-(4-naphthalen-2-ylphenyl)imidazo[2,1-b][1,3]benzothiazole
PubChem CID11712228
Molecular FormulaC25H16N2S
Molecular Weight376.48 g/mol
Exact Mass376.10
IUPAC Name2-(4-naphthalen-2-ylphenyl)imidazo[2,1-b][1,3]benzothiazole
SMILESc1ccc2cc(-c3ccc(-c4cn5c(n4)sc4ccccc45)cc3)ccc2c1
InChIInChI=1S/C25H16N2S/c1-2-6-20-15-21(14-11-17(20)5-1)18-9-12-19(13-10-18)22-16-27-23-7-3-4-8-24(23)28-25(27)26-22/h1-16H
InChIKeyBBYZTCUEWXBKGG-UHFFFAOYSA-N
XLogP7.04
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500376.48
LogP ≤ 57.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-(4-naphthalen-2-ylphenyl)imidazo[2,1-b][1,3]benzothiazole with MolForge

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

Launch Full Analysis

Related Compounds

Pifithrin-Beta
CID 443278
2-Phenyl-5,6,7,8-tetrahydroimidazo[2,1-b][1,3]benzothiazole
CID 760886
1H-Imidazole-5-methanamine, 1-[(3-amino[1,1'-biphenyl]-4-yl)methyl]-N-[6-(2-benzothiazolyl)[1,1'-biphenyl]-3-yl]-
CID 44157365
2-(4-Bromophenyl)imidazo[2,1-b][1,3]benzothiazole
CID 667715
2-(4-Methylphenyl)imidazo[2,1-b][1,3]benzothiazole
CID 2760645
2-(4-Pyrrolidin-1-ylphenyl)imidazo[2,1-b][1,3]benzothiazole
CID 11509560
7-Fluoro-2-(4-dimethylaminophenyl)-imidazo[2,1-b]benzothiazole
CID 24757875
4-Imidazo[2,1-b][1,3]benzothiazol-2-ylaniline
CID 28325580
2-(3-Nitrophenyl)imidazo(2,1-B)(1,3)benzothiazole
CID 1477847
CID 6603392
CID 6603392
4-(1,3-benzothiazol-2-yl)-3-phenyl-N-[[3-[(4-phenylphenyl)methyl]imidazol-4-yl]methyl]aniline
CID 9984979
2-(4-Methylbenzyl)-6-phenylimidazo[2,1-b][1,3]thiazole
CID 15991403

Frequently Asked Questions

What is the IUPAC name of 2-(4-naphthalen-2-ylphenyl)imidazo[2,1-b][1,3]benzothiazole?
The IUPAC name of 2-(4-naphthalen-2-ylphenyl)imidazo[2,1-b][1,3]benzothiazole (CID 11712228) is 2-(4-naphthalen-2-ylphenyl)imidazo[2,1-b][1,3]benzothiazole.
What is the SMILES notation for 2-(4-naphthalen-2-ylphenyl)imidazo[2,1-b][1,3]benzothiazole?
The canonical SMILES for 2-(4-naphthalen-2-ylphenyl)imidazo[2,1-b][1,3]benzothiazole is c1ccc2cc(-c3ccc(-c4cn5c(n4)sc4ccccc45)cc3)ccc2c1.
What is the InChIKey of 2-(4-naphthalen-2-ylphenyl)imidazo[2,1-b][1,3]benzothiazole?
The InChIKey is BBYZTCUEWXBKGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H16N2S/c1-2-6-20-15-21(14-11-17(20)5-1)18-9-12-19(13-10-18)22-16-27-23-7-3-4-8-24(23)28-25(27)26-22/h1-16H.
What are the key properties of 2-(4-naphthalen-2-ylphenyl)imidazo[2,1-b][1,3]benzothiazole?
2-(4-naphthalen-2-ylphenyl)imidazo[2,1-b][1,3]benzothiazole has a molecular weight of 376.48 g/mol, XLogP of 7.04, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-naphthalen-2-ylphenyl)imidazo[2,1-b][1,3]benzothiazole is sourced from PubChem (CID 11712228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).