(2S,4R)-2-phenyl-1,3-thiazolidine-4-carboxylic acid
Basic information
- CAS
59999-67-6- Standard SMILES
O=C(O)[C@@H]1CS[C@@H](c2ccccc2)N1- InChIKey
AZDYQBFYMBALBY-IUCAKERBSA-N- Molecular formula
- C10H11NO2S
- Average molar mass
- 209.27 g/mol
- Monoisotopic mass
- 209.05104977
Names & identifiers
- Preferred name
- (2S,4R)-2-phenyl-1,3-thiazolidine-4-carboxylic acid
- IUPAC
- (2S,4R)-2-phenyl-1,3-thiazolidine-4-carboxylic acid
Names & synonyms
(2S,4R)-2-phenyl-1,3-thiazolidine-4-carboxylic acid4-Thiazolidinecarboxylic acid, 2-phenyl-, (2S,4R)-59999-67-6AC1LDX9ADTXSID40350334AKOS024438904
Database identifiers
- CAS
59999-67-6- PubChem CID
- 676744
- DTXSID
DTXSID40350334- Nikkaji
- J3.599.528E
Properties
Computed structural properties
- XLogP
- -0.8
- Topological polar surface area
- 74.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 216
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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