LU 4-064 hydrochloride
Basic information
- CAS
26106-00-3- Standard SMILES
C[NH+](C)CCCC1(c2ccccc2)SCc2ccccc21.[Cl-]- InChIKey
VSWNHWPQNUCKEF-UHFFFAOYSA-N- Molecular formula
- C19H24ClNS
- Average molar mass
- 333.9 g/mol
- Monoisotopic mass
- 333.1317986
Names & identifiers
- Preferred name
- LU 4-064 hydrochloride
- IUPAC
- dimethyl-[3-(1-phenyl-3H-2-benzothiophen-1-yl)propyl]azanium chloride
Names & synonyms
LU 4-064 hydrochloride26106-00-3RefChem:10885721,3-Dihydro-N,N-dimethyl-1-phenylbenzo(c)thiophene-1-propylamine hydrochlorideBenzo(c)thiophene-1-propylamine, 1,3-dihydro-N,N-dimethyl-1-phenyl-, hydrochloride
Database identifiers
- CAS
26106-00-3- PubChem CID
- 33310
Properties
Computed structural properties
- Topological polar surface area
- 29.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 324
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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