Basic information
- Standard SMILES
Cc1c(Cl)cccc1S(=O)(=O)n1ccc2c(N3CCNCC3)nccc21.Cl- InChIKey
WMOCVXUBXJDJPO-UHFFFAOYSA-N- Molecular formula
- C18H20Cl2N4O2S
- Average molar mass
- 427.3 g/mol
- Monoisotopic mass
- 426.0684025
Names & identifiers
- Preferred name
- 1-(3-Chloro-2-methyl-benzenesulfonyl)-4-piperazin-1-yl-1H-pyrrolo[3,2-c]pyridine Hydrochloride
- IUPAC
- 1-(3-chloro-2-methylphenyl)sulfonyl-4-piperazin-1-ylpyrrolo[3,2-c]pyridine;hydrochloride
Names & synonyms
SCHEMBL1776556WMOCVXUBXJDJPO-UHFFFAOYSA-N1-(3-Chloro-2-methyl-benzenesulfonyl)-4-piperazin-1-yl-1H-pyrrolo[3,2-c]pyridine Hydrochloride
Database identifiers
- PubChem CID
- 67157591
Properties
Computed structural properties
- Topological polar surface area
- 75.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 592
Related reactions
1 records
Compound notes
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