6-(4-Methylphenyl)imidazo[2,1-b][1,3,4]thiadiazole
Basic information
- CAS
57771-98-9- Standard SMILES
Cc1ccc(-c2cn3ncsc3n2)cc1- InChIKey
KLVOYOMLAVRBSH-UHFFFAOYSA-N- Molecular formula
- C11H9N3S
- Average molar mass
- 215.28 g/mol
- Monoisotopic mass
- 215.05171847
Names & identifiers
- Preferred name
- 6-(4-Methylphenyl)imidazo[2,1-b][1,3,4]thiadiazole
- IUPAC
- 6-(4-methylphenyl)imidazo[2,1-b][1,3,4]thiadiazole
Names & synonyms
57771-98-9Imidazo[2,1-b]-1,3,4-thiadiazole, 6-(4-methylphenyl)-6-(4-methylphenyl)imidazo[2,1-b][1,3,4]thiadiazoleSCHEMBL2996722DTXSID401229982AKOS002318098CCG-241964ST507775556-(4-Methylphenyl)imidazo[2,1-b]-1,3,4-thiadiazole6-(4-methylphenyl)imidazo[2,1-b]1,3,4-thiadiazoline
Database identifiers
- CAS
57771-98-9- PubChem CID
- 2806479
- DTXSID
DTXSID401229982
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 58.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 228
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…