Basic information
- Standard SMILES
COC1CN(C(=O)Cc2ccc(F)cc2)N(C(=O)OCc2ccccc2)C1- InChIKey
BOYHBAGUJONEOG-UHFFFAOYSA-N- Molecular formula
- C20H21FN2O4
- Average molar mass
- 372.4 g/mol
Names & identifiers
- Preferred name
- 2-[2-(4-Fluorophenyl)acetyl]4-methoxy-pyrazolidine-1-carboxylic acid benzyl ester
- IUPAC
- benzyl 2-[2-(4-fluorophenyl)acetyl]-4-methoxypyrazolidine-1-carboxylate
Names & synonyms
SCHEMBL4856618BOYHBAGUJONEOG-UHFFFAOYSA-N2-[2-(4-fluorophenyl)acetyl]-4-methoxy-pyrazolidine-1-carboxylic acid benzyl ester2-[2-(4-Fluorophenyl)acetyl]4-methoxy-pyrazolidine-1-carboxylic acid benzyl ester
Database identifiers
- PubChem CID
- 20724745
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 59.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 504
Related reactions
12 records
Compound notes
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