Basic information
- Standard SMILES
COc1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)O)cc1- InChIKey
LWZATQDWEXAGQR-LLVKDONJSA-N- Molecular formula
- C12H15NO5S
- Average molar mass
- 285.32 g/mol
Names & identifiers
- Preferred name
- 1-[(4-Methoxyphenyl)sulfonyl]-D-proline
- IUPAC
- (2R)-1-(4-methoxyphenyl)sulfonylpyrrolidine-2-carboxylic acid
Names & synonyms
SCHEMBL2706480LWZATQDWEXAGQR-LLVKDONJSA-NEiM07-29957AKOS0173370341-[(4-Methoxyphenyl)sulfonyl]-D-proline1-[4-Methoxybenzenesulfonyl]-pyrrolidine-2(R)-carboxylic acid
Database identifiers
- PubChem CID
- 744902
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 92.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 422
Related reactions
9 records
Compound notes
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