Basic information
- Standard SMILES
Cl.O=S(=O)(c1ccccc1)c1n[nH]c2cccc(N3CCNCC3)c12- InChIKey
OGHVJKMIZMMECE-UHFFFAOYSA-N- Molecular formula
- C17H19ClN4O2S
- Average molar mass
- 378.9 g/mol
- Monoisotopic mass
- 378.0917247
Names & identifiers
- Preferred name
- 3-(Phenylsulfonyl)-4-piperazin-1-yl-1H-indazole Hydrochloride
- IUPAC
- 3-(benzenesulfonyl)-4-piperazin-1-yl-2H-indazole;hydrochloride
Names & synonyms
SCHEMBL3954209OGHVJKMIZMMECE-UHFFFAOYSA-N3-(Phenylsulfonyl)-4-piperazin-1-yl-1H-indazole Hydrochloride
Database identifiers
- PubChem CID
- 44243051
Properties
Computed structural properties
- Topological polar surface area
- 86.5 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 523
Related reactions
2 records
Compound notes
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