Basic information
- Standard SMILES
CS(=O)(=O)Nc1cc([C@@H](O)CNC2CCN(c3ccc(S(=O)(=O)NCCO)cc3)CC2)ccc1O- InChIKey
QSVAVWGGMPAMHQ-QFIPXVFZSA-N- Molecular formula
- C22H32N4O7S2
- Average molar mass
- 528.6 g/mol
Names & identifiers
- Preferred name
- N-(2-Hydroxyethyl)-4-{4-[(2R)-2-hydroxy-2-(4-hydroxy-3-methanesulfonylamino-phenyl)-ethylamino]-piperidin-1-yl)-benzenesulfonamide
- IUPAC
- N-(2-hydroxyethyl)-4-[4-[[(2R)-2-hydroxy-2-[4-hydroxy-3-(methanesulfonamido)phenyl]ethyl]amino]piperidin-1-yl]benzenesulfonamide
Names & synonyms
N-(2-Hydroxyethyl)-4-{4-[(2R)-2-hydroxy-2-(4-hydroxy-3-methanesulfonylamino-phenyl)-ethylamino]-piperidin-1-yl)-benzenesulfonamideN-(2-Hydroxyethyl)-4-{4-[(2R)-2-hydroxy-2-(4-hydroxy-3-methanesulfonylamino-phenyl)-ethylamino]-piperidin-1-yl}-benzenesulfonamideSCHEMBL6801642QSVAVWGGMPAMHQ-QFIPXVFZSA-N
Database identifiers
- PubChem CID
- 10301949
Properties
Computed structural properties
- XLogP
- -0.1
- Topological polar surface area
- 185 Ų
- Hydrogen bond donors
- 6
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 11
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 846
Related reactions
2 records
Compound notes
Loading…