Basic information
- Standard SMILES
COC(C)(C)OCc1cc2ccn(S(=O)(=O)c3ccccc3)c2cc1Br- InChIKey
OYKNLGSHFXQPQG-UHFFFAOYSA-N- Molecular formula
- C19H20BrNO4S
- Average molar mass
- 438.3 g/mol
- Monoisotopic mass
- 437.02964
Names & identifiers
- Preferred name
- 1-benzenesulfonyl-6-bromo-5-(1-methoxy-1-methyl-ethoxymethyl)-1H-indole
- IUPAC
- 1-(benzenesulfonyl)-6-bromo-5-(2-methoxypropan-2-yloxymethyl)indole
Names & synonyms
SCHEMBL3092056OYKNLGSHFXQPQG-UHFFFAOYSA-N1-benzenesulfonyl-6-bromo-5-(1-methoxy-1-methyl-ethoxymethyl)-1H-indole
Database identifiers
- PubChem CID
- 59488773
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 65.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 571
Related reactions
3 records
Compound notes
Loading…