Basic information
- Standard SMILES
CN1CCN(S(=O)(=O)c2cnc(Cl)c(Br)c2)CC1- InChIKey
DMXGFDSGVSISBY-UHFFFAOYSA-N- Molecular formula
- C10H13BrClN3O2S
- Average molar mass
- 354.65 g/mol
Names & identifiers
- Preferred name
- 1-[(5-Bromo-6-chloropyridin-3-yl)sulfonyl]-4-methylpiperazine
- IUPAC
- 1-[(5-bromo-6-chloro-3-pyridinyl)sulfonyl]-4-methylpiperazine
Names & synonyms
247583-86-41-[(5-bromo-6-chloropyridin-3-yl)sulfonyl]-4-methylpiperazine1-(5-bromo-6-chloropyridin-3-yl)sulfonyl-4-methylpiperazine1-((5-bromo-6-chloropyridin-3-yl)sulfonyl)-4-methylpiperazineMLS000580299DMXGFDSGVSISBY-UHFFFAOYSA-NSCHEMBL3581112CHEMBL1447176HMS2563M181-[(5-bromo-6-chloro-3-pyridinyl)sulfonyl]-4-methylpiperazineSTL346026AKOS002729365
Show more names
SMR000220480DB-337003AF-399/423098661-(5-Bromo-6-chloro-pyridine-3-sulfonyl)-4-methyl-piperazine
Database identifiers
- PubChem CID
- 3957358
- ChEMBL
CHEMBL1447176
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 61.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 381
Related reactions
2 records
Compound notes
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