Basic information
- CAS
173908-44-6- Standard SMILES
Nc1ccccc1S(=O)(=O)n1ccc2ccccc21- InChIKey
DCPWJRMUSRUXQT-UHFFFAOYSA-N- Molecular formula
- C14H12N2O2S
- Average molar mass
- 272.32 g/mol
- Monoisotopic mass
- 272.0619488
Names & identifiers
- Preferred name
- 1H-Indole, 1-((2-aminophenyl)sulfonyl)-
- IUPAC
- 2-indol-1-ylsulfonylaniline
Names & synonyms
173908-44-61H-Indole, 1-((2-aminophenyl)sulfonyl)-1-((2-Aminophenyl)sulfonyl)-1H-indole1-[(2-Aminophenyl)sulfonyl]-1H-indole1H-Indole, 1-[(2-aminophenyl)sulfonyl]-2-(1H-indol-1-ylsulfonyl)aniline2-indol-1-ylsulfonylanilineCHEMBL149104DTXSID501697172-(1H-Indole-1-sulfonyl)aniline
Database identifiers
- CAS
173908-44-6- PubChem CID
- 464786
- DTXSID
DTXSID50169717- ChEMBL
CHEMBL149104
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 73.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 418
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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