Basic information
- Standard SMILES
CN1CCN(S(=O)(=O)c2ccc(-c3c(O)[nH]c4ccccc34)nc2)CC1.Cl- InChIKey
AUBFRFKDPRVUMI-UHFFFAOYSA-N- Molecular formula
- C18H21ClN4O3S
- Average molar mass
- 408.9 g/mol
Names & identifiers
- Preferred name
- 3-{5-[(4-Methylpiperazin-1-yl)sulfonyl]pyridin-2-yl}-1H-indol-2-ol hydrochloride
- IUPAC
- 3-[5-(4-methylpiperazin-1-yl)sulfonyl-2-pyridinyl]-1H-indol-2-ol;hydrochloride
Names & synonyms
SCHEMBL4066080AUBFRFKDPRVUMI-UHFFFAOYSA-N3-{5-[(4-Methylpiperazin-1-yl)sulfonyl]pyridin-2-yl}-1H-indol-2-ol hydrochloride
Database identifiers
- PubChem CID
- 136342123
Properties
Computed structural properties
- Topological polar surface area
- 97.9 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 588
Related reactions
1 records
Compound notes
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