Basic information
- Standard SMILES
CCOC(=O)CCc1nccn1-c1ccc(F)cc1N- InChIKey
DVHKNVFQYWXSBY-UHFFFAOYSA-N- Molecular formula
- C14H16FN3O2
- Average molar mass
- 277.29 g/mol
Names & identifiers
- Preferred name
- Ethyl 3-[1-(2-amino-4-fluorophenyl)-1H-imidazol-2-yl]-propanoate
- IUPAC
- ethyl 3-[1-(2-amino-4-fluorophenyl)imidazol-2-yl]propanoate
Names & synonyms
SCHEMBL3583217DVHKNVFQYWXSBY-UHFFFAOYSA-NEthyl 3-[1-(2-amino-4-fluorophenyl)-1H-imidazol-2-yl]-propanoate
Database identifiers
- PubChem CID
- 59198670
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 70.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 330
Related reactions
7 records
Compound notes
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