Basic information
- Standard SMILES
NCCNS(=O)(=O)c1cc(-c2ccccc2)cc2cnccc12- InChIKey
PFSNDWGTZAJDGN-UHFFFAOYSA-N- Molecular formula
- C17H17N3O2S
- Average molar mass
- 327.4 g/mol
Names & identifiers
- Preferred name
- 7-Phenyl-isoquinoline-5-sulfonic acid (2-amino-ethyl)-amide
- IUPAC
- N-(2-aminoethyl)-7-phenylisoquinoline-5-sulfonamide
Names & synonyms
SCHEMBL14013848SCHEMBL29915198PFSNDWGTZAJDGN-UHFFFAOYSA-N7-phenyl-isoquinoline -5-sulfonic acid (2-amino-ethyl)-amide7-phenyl-isoquinoline-5-sulfonic acid (2-amino-ethyl)-amide
Database identifiers
- PubChem CID
- 11290356
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 93.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 471
Related reactions
5 records
Compound notes
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