Basic information
- Standard SMILES
CC(C)(C)OC(=O)N1C[C@H](SC(c2ccccc2)(c2ccccc2)c2ccccc2)C[C@H]1CO- InChIKey
DVSPQOWIGAOONB-IZZNHLLZSA-N- Molecular formula
- C29H33NO3S
- Average molar mass
- 475.6 g/mol
Names & identifiers
- Preferred name
- (2S,4R)-2-hydroxymethyl-4-tritylsulfanyl-pyrrolidine-1-carboxylic acid tert-butyl ester
- IUPAC
- tert-butyl (2S,4R)-2-(hydroxymethyl)-4-tritylsulfanylpyrrolidine-1-carboxylate
Names & synonyms
SCHEMBL5404919DVSPQOWIGAOONB-IZZNHLLZSA-N(2S,4R)-2-hydroxymethyl-4-tritylsulfanyl-pyrrolidine-1-carboxylic acid tert-butyl ester
Database identifiers
- PubChem CID
- 11271474
Properties
Computed structural properties
- XLogP
- 6
- Topological polar surface area
- 75.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 599
Related reactions
9 records
Compound notes
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