Basic information
- Standard SMILES
Cc1nc(C#CCCc2nc3ccccc3s2)cs1- InChIKey
VXUPWWZQDMBCMP-UHFFFAOYSA-N- Molecular formula
- C15H12N2S2
- Average molar mass
- 284.4 g/mol
Names & identifiers
- Preferred name
- 2-(4-(2-Methylthiazol-4-yl)but-3-ynyl)benzo[d]thiazole
- IUPAC
- 2-[4-(2-methyl-1,3-thiazol-4-yl)but-3-ynyl]-1,3-benzothiazole
Names & synonyms
SCHEMBL103069VXUPWWZQDMBCMP-UHFFFAOYSA-N2-(4-(2-methylthiazol-4-yl)but-3-ynyl)benzo[d]thiazole
Database identifiers
- PubChem CID
- 11637767
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 82.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 373
Related reactions
4 records
Compound notes
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