(2S,4R)-2-benzyloxymethyl-4-tritylsulfanyl-pyrrolidine-1-sulfonic acid
Basic information
- Standard SMILES
O=S(=O)(O)N1C[C@H](SC(c2ccccc2)(c2ccccc2)c2ccccc2)C[C@H]1COCc1ccccc1- InChIKey
FIANZGXAXIMXIM-XZWHSSHBSA-N- Molecular formula
- C31H31NO4S2
- Average molar mass
- 545.7 g/mol
Names & identifiers
- Preferred name
- (2S,4R)-2-benzyloxymethyl-4-tritylsulfanyl-pyrrolidine-1-sulfonic acid
- IUPAC
- (2S,4R)-2-(phenylmethoxymethyl)-4-tritylsulfanylpyrrolidine-1-sulfonic acid
Names & synonyms
SCHEMBL5416646FIANZGXAXIMXIM-XZWHSSHBSA-N(2S,4R)-2-benzyloxymethyl-4-tritylsulfanyl-pyrrolidine-1-sulfonic acid
Database identifiers
- PubChem CID
- 69433587
Properties
Computed structural properties
- XLogP
- 6
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 10
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 761
Related reactions
2 records
Compound notes
Loading…