Quinoline, 2-((3-(dimethylamino)propyl)thio)-4-phenyl-, monohydrochloride
Basic information
- CAS
97633-99-3- Standard SMILES
CN(C)CCCSc1cc(-c2ccccc2)c2ccccc2n1.Cl- InChIKey
XVDDLLDNGKBMQH-UHFFFAOYSA-N- Molecular formula
- C20H23ClN2S
- Average molar mass
- 358.9 g/mol
- Monoisotopic mass
- 358.1270476
Names & identifiers
- Preferred name
- Quinoline, 2-((3-(dimethylamino)propyl)thio)-4-phenyl-, monohydrochloride
- IUPAC
- N,N-dimethyl-3-(4-phenylquinolin-2-yl)sulfanylpropan-1-amine;hydrochloride
Names & synonyms
Quinoline, 2-((3-(dimethylamino)propyl)thio)-4-phenyl-, monohydrochloride2-((3-(Dimethylamino)propyl)thio)-4-phenylquinoline hydrochloride97633-99-3DTXSID50243081RefChem:378508DTXCID50165572CHEMBL539494N,N-Dimethyl-3-[(4-phenylquinolin-2-yl)sulfanyl]propan-1-amine--hydrogen chloride (1/1)
Database identifiers
- CAS
97633-99-3- PubChem CID
- 3024971
- DTXSID
DTXSID50243081- ChEMBL
CHEMBL539494
Properties
Computed structural properties
- Topological polar surface area
- 41.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 341
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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