Basic information
- Standard SMILES
CCCCCCCCCCCCCCCCNc1ccc(C(=O)N2CSCC2C(=O)O)cc1- InChIKey
AGCXUBVGFROKIT-UHFFFAOYSA-N- Molecular formula
- C27H44N2O3S
- Average molar mass
- 476.7 g/mol
Names & identifiers
- Preferred name
- 3-[4-(Hexadecylamino)benzoyl]-4-carboxythiazolidine
- IUPAC
- 3-[4-(hexadecylamino)benzoyl]-1,3-thiazolidine-4-carboxylic acid
Names & synonyms
SCHEMBL11073246AGCXUBVGFROKIT-UHFFFAOYSA-N3-[4-(hexadecylamino)benzoyl]-4-carboxythiazolidine
Database identifiers
- PubChem CID
- 20437365
Properties
Computed structural properties
- XLogP
- 9.3
- Topological polar surface area
- 94.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 18
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 537
Related reactions
3 records
Compound notes
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