Basic information
- Standard SMILES
CC(=O)N1CCN(c2ccc(NC(=O)Cc3ccc(-c4ccnc(F)c4)cc3)nc2)CC1- InChIKey
TZXRHWSHKKGYPR-UHFFFAOYSA-N- Molecular formula
- C24H24FN5O2
- Average molar mass
- 433.5 g/mol
- Monoisotopic mass
- 433.19140319
Names & identifiers
- Preferred name
- N-(5-(4-acetylpiperazin-1-yl)pyridin-2-yl)-2-(4-(2-fluoropyridin-4-yl)phenyl)acetamide
- IUPAC
- N-[5-(4-acetylpiperazin-1-yl)-2-pyridinyl]-2-[4-(2-fluoro-4-pyridinyl)phenyl]acetamide
Names & synonyms
N-(5-(4-acetylpiperazin-1-yl)pyridin-2-yl)-2-(4-(2-fluoropyridin-4-yl)phenyl)acetamideSCHEMBL1723746CHEMBL5815787TZXRHWSHKKGYPR-UHFFFAOYSA-NBDBM374982US10251893, Cpd 178
Database identifiers
- PubChem CID
- 58447697
- ChEMBL
CHEMBL5815787
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 78.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 634
Related reactions
3 records
Compound notes
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