6-(4-azidophenyl)imidazo[2,1-b][1,3]thiazole

C11H7N5S — CID 150120131

IUPAC6-(4-azidophenyl)imidazo[2,1-b][1,3]thiazole
SMILES[N-]=[N+]=Nc1ccc(-c2cn3ccsc3n2)cc1
InChIInChI=1S/C11H7N5S/c12-15-14-9-3-1-8(2-4-9)10-7-16-5-6-17-11(16)13-10/h1-7H
InChIKeyDZBONAKYPSOUBT-UHFFFAOYSA-N
MW241.28 g/mol
LogP4.00
Rot. Bonds2

About 6-(4-azidophenyl)imidazo[2,1-b][1,3]thiazole

6-(4-azidophenyl)imidazo[2,1-b][1,3]thiazole (PubChem CID 150120131) has the molecular formula C11H7N5S and a molecular weight of 241.28 g/mol. Its IUPAC name is 6-(4-azidophenyl)imidazo[2,1-b][1,3]thiazole.

Molecular Properties

Compound Name6-(4-azidophenyl)imidazo[2,1-b][1,3]thiazole
PubChem CID150120131
Molecular FormulaC11H7N5S
Molecular Weight241.28 g/mol
Exact Mass241.04
IUPAC Name6-(4-azidophenyl)imidazo[2,1-b][1,3]thiazole
SMILES[N-]=[N+]=Nc1ccc(-c2cn3ccsc3n2)cc1
InChIInChI=1S/C11H7N5S/c12-15-14-9-3-1-8(2-4-9)10-7-16-5-6-17-11(16)13-10/h1-7H
InChIKeyDZBONAKYPSOUBT-UHFFFAOYSA-N
XLogP4.00
TPSA66.06 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.28
LogP ≤ 54.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

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Related Compounds

6-[4-(2-methoxyethyl)phenyl]imidazo[2,1-b][1,3]thiazole
CID 115403295
6-(4-butoxyphenyl)imidazo[2,1-b][1,3]thiazole
CID 19224481
6-thiophen-3-ylimidazo[2,1-b][1,3]thiazole
CID 10352957
methyl N-cyano-N'-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)carbamimidothioate
CID 169363017
1-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-3-(4-methylphenyl)urea
CID 43936533
1-bromo-N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)methanesulfonamide
CID 83084144
1-chloro-3-(4-imidazo[2,1-b][1,3]thiazol-6-ylanilino)propan-2-ol
CID 168639157
N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)butanamide
CID 852131
N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-2-(methylamino)propanamide
CID 62639517
2-hydroxy-N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)benzamide
CID 37039072
(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl) propane-1-sulfonate
CID 166176644
6-(2,5-difluorophenyl)imidazo[2,1-b][1,3]thiazole
CID 115281719

Frequently Asked Questions

What is the IUPAC name of 6-(4-azidophenyl)imidazo[2,1-b][1,3]thiazole?
The IUPAC name of 6-(4-azidophenyl)imidazo[2,1-b][1,3]thiazole (CID 150120131) is 6-(4-azidophenyl)imidazo[2,1-b][1,3]thiazole.
What is the SMILES notation for 6-(4-azidophenyl)imidazo[2,1-b][1,3]thiazole?
The canonical SMILES for 6-(4-azidophenyl)imidazo[2,1-b][1,3]thiazole is [N-]=[N+]=Nc1ccc(-c2cn3ccsc3n2)cc1.
What is the InChIKey of 6-(4-azidophenyl)imidazo[2,1-b][1,3]thiazole?
The InChIKey is DZBONAKYPSOUBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7N5S/c12-15-14-9-3-1-8(2-4-9)10-7-16-5-6-17-11(16)13-10/h1-7H.
What are the key properties of 6-(4-azidophenyl)imidazo[2,1-b][1,3]thiazole?
6-(4-azidophenyl)imidazo[2,1-b][1,3]thiazole has a molecular weight of 241.28 g/mol, XLogP of 4.00, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-azidophenyl)imidazo[2,1-b][1,3]thiazole is sourced from PubChem (CID 150120131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).