Basic information
- CAS
367928-69-6- Standard SMILES
CCOc1ccc(C2NC(C(=O)O)CS2)cc1OC- InChIKey
AQAPHTGLTLLHQO-UHFFFAOYSA-N- Molecular formula
- C13H17NO4S
- Average molar mass
- 283.35 g/mol
- Monoisotopic mass
- 283.0878292
Names & identifiers
- Preferred name
- 2-(4-Ethoxy-3-methoxyphenyl)-1,3-thiazolidine-4-carboxylic acid
- IUPAC
- 2-(4-ethoxy-3-methoxyphenyl)-1,3-thiazolidine-4-carboxylic acid
Names & synonyms
2-(4-ethoxy-3-methoxyphenyl)-1,3-thiazolidine-4-carboxylic acidDTXSID101194643CCG-26012STK677022AKOS005594510367928-69-6ST093106EU-0052696SR-01000531789SR-01000531789-12-(4-Ethoxy-3-methoxyphenyl)-4-thiazolidinecarboxylic acid
Database identifiers
- CAS
367928-69-6- PubChem CID
- 4075142
- DTXSID
DTXSID101194643
Properties
Computed structural properties
- XLogP
- -0.5
- Topological polar surface area
- 93.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 315
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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