Basic information
- Standard SMILES
Nc1n(CC(=O)c2cccs2)c2ccccc2[n+]1CCN1CCCCC1.[Br-]- InChIKey
UMPIDSZBAQZZPD-UHFFFAOYSA-N- Molecular formula
- C20H25BrN4OS
- Average molar mass
- 449.4 g/mol
- Monoisotopic mass
- 448.09325
Names & identifiers
- Preferred name
- 2-(2-imino-3-(2-(piperidin-1-yl)ethyl)-2,3-dihydro-1H-benzo[d]imidazol-1-yl)-1-(thiophen-2-yl)ethanone hydrobromide
- IUPAC
- 2-[2-imino-3-(2-piperidin-1-ylethyl)benzimidazol-1-yl]-1-thiophen-2-ylethanone;hydrobromide
Names & synonyms
2-(2-imino-3-(2-(piperidin-1-yl)ethyl)-2,3-dihydro-1H-benzo[d]imidazol-1-yl)-1-(thiophen-2-yl)ethanone hydrobromideMLS000687583CHEMBL1712369AKOS030507129SMR000283357
Database identifiers
- PubChem CID
- 16189276
Properties
Computed structural properties
- Topological polar surface area
- 78.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 522
Related reactions
4 records
Compound notes
Loading…