Basic information
- Standard SMILES
CNC(=O)c1ccc(-c2nccnc2C2CCN(c3ccc4cc(F)ccc4n3)CC2)cc1F- InChIKey
WZEAPCRPXBGWOP-UHFFFAOYSA-N- Molecular formula
- C26H23F2N5O
- Average molar mass
- 459.5 g/mol
- Monoisotopic mass
- 459.1870667
Names & identifiers
- Preferred name
- 2-fluoro-4-(3-(1-(6-fluoroquinolin-2-yl)piperidin-4-yl)pyrazin-2-yl)-N-methylbenzamide
- IUPAC
- 2-fluoro-4-[3-[1-(6-fluoroquinolin-2-yl)piperidin-4-yl]pyrazin-2-yl]-N-methylbenzamide
Names & synonyms
CHEMBL3675647SCHEMBL15540403WZEAPCRPXBGWOP-UHFFFAOYSA-NBDBM119838US8691986, 42-fluoro-4-(3-(1-(6-fluoroquinolin-2-yl)piperidin-4-yl)pyrazin-2-yl)-N-methylbenzamide
Database identifiers
- PubChem CID
- 72714756
- ChEMBL
CHEMBL3675647
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 71 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 690
Related reactions
2 records
Compound notes
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