3-Methyl-6-phenylimidazo[2,1-b][1,3]thiazole
Basic information
- CAS
25968-20-1- Standard SMILES
Cc1csc2nc(-c3ccccc3)cn12- InChIKey
DCMZKFFVBKTHRE-UHFFFAOYSA-N- Molecular formula
- C12H10N2S
- Average molar mass
- 214.29 g/mol
- Monoisotopic mass
- 214.0564695
Names & identifiers
- Preferred name
- 3-Methyl-6-phenylimidazo[2,1-b][1,3]thiazole
- IUPAC
- 3-methyl-6-phenylimidazo[2,1-b][1,3]thiazole
- English name
- Imidazo[2,1-b]thiazole,3-methyl-6-phenyl-
- Molecular formula
- C12H10N2S
- Molecular weight
- 214.29
Names & synonyms
25968-20-13-methyl-6-phenylimidazo[2,1-b][1,3]thiazole3-methyl-6-phenylimidazo[2,1-b]thiazoleImidazo[2,1-b]thiazole,3-methyl-6-phenyl-NSC351164Enamine_0007623-Methyl-6-phenyl-imidazo[2,1-b]thiazoleCambridge id 6886469SCHEMBL5549381CHEMBL5488127DTXSID00319826HMS1396C14
Show more names
STK825417AKOS001029943NSC-351164ST50401991Imidazo[2,1-b]thiazole, 3-methyl-6-phenyl-3-methyl-6-phenylimidazo[2,1-b]1,3-thiazolineAB-601/30966049SR-01000245763
Database identifiers
- CAS
25968-20-1- PubChem CID
- 336506
- DTXSID
DTXSID00319826- ChEMBL
CHEMBL5488127- Nikkaji
- J1.138.618K
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 45.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 228
Physicochemical properties
- Melting point
- 113 °C · 113 °C(Solv: ligroine (8032-32-4))
- Density
- 1.26 · 1.26±0.1 g/cm3(Predicted)
- pka
- 6.41 · 6.41±0.40(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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