Basic information
- Standard SMILES
CCOC(=O)Cc1sc(NC)nc1C(C)c1ccc(-c2ccccc2)c(F)c1- InChIKey
FYYFCTQKQBHJCD-UHFFFAOYSA-N- Molecular formula
- C22H23FN2O2S
- Average molar mass
- 398.5 g/mol
- Monoisotopic mass
- 398.14642732
Names & identifiers
- Preferred name
- Ethyl 2-(4-(1-(2-fluoro-4-biphenylyl)ethyl)-2-methylamino-5-thiazolyl)acetate
- IUPAC
- ethyl 2-[4-[1-(3-fluoro-4-phenylphenyl)ethyl]-2-(methylamino)-1,3-thiazol-5-yl]acetate
Names & synonyms
SCHEMBL9461225FYYFCTQKQBHJCD-UHFFFAOYSA-Nethyl 2-(4-(1-(2-fluoro-4-biphenylyl)ethyl)-2-methylamino-5-thiazolyl)acetate
Database identifiers
- PubChem CID
- 19785542
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 79.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 503
Related reactions
1 records
Compound notes
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