Basic information
- Standard SMILES
Cl.O=S(=O)(c1ccccc1)c1cnc2c(N3CCNCC3)cccc2c1- InChIKey
BWLWNUQEZNYKAU-UHFFFAOYSA-N- Molecular formula
- C19H20ClN3O2S
- Average molar mass
- 389.9 g/mol
- Monoisotopic mass
- 389.0964758
Names & identifiers
- Preferred name
- 3-Phenylsulfonyl-8-piperazin-1-yl-quinoline hydrochloride
- IUPAC
- 3-(benzenesulfonyl)-8-piperazin-1-ylquinoline;hydrochloride
Names & synonyms
607742-55-2SB 742457 hydrochloride3-Phenylsulfonyl-8-piperazin-1-yl-quinoline hydrochloride3-(Phenylsulfonyl)-8-(piperazin-1-yl)quinoline hydrochloride3-(benzenesulfonyl)-8-piperazin-1-ylquinoline;hydrochlorideIntepirdine HClSCHEMBL2197942GSK 742457 HClBWLWNUQEZNYKAU-UHFFFAOYSA-N3-BENZENESULFONYL-8-PIPERAZIN-1-YL-QUINOLINE HYDROCHLORIDEE98856
Database identifiers
- PubChem CID
- 56972141
Properties
Computed structural properties
- Topological polar surface area
- 70.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 535
Related reactions
9 records
Compound notes
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