Basic information
- Standard SMILES
O=C(Cc1cnc(-c2ccnc(F)c2)c(F)c1)Nc1ccc(-c2cccnn2)cn1- InChIKey
YPFUBKSFIHXNAG-UHFFFAOYSA-N- Molecular formula
- C21H14F2N6O
- Average molar mass
- 404.4 g/mol
- Monoisotopic mass
- 404.11971542
Names & identifiers
- Preferred name
- US10251893, Cpd 210
- IUPAC
- 2-[5-fluoro-6-(2-fluoro-4-pyridinyl)-3-pyridinyl]-N-(5-pyridazin-3-yl-2-pyridinyl)acetamide
Names & synonyms
SCHEMBL1724190CHEMBL5892163YPFUBKSFIHXNAG-UHFFFAOYSA-NBDBM375014US10251893, Cpd 2102-(2'',3-difluoro-2,4''-bipyridin-5-yl)-N-(5-(pyridazin-3-yl)pyridin-2-yl)acetamide2-(2',3-difluoro-2,4'-bipyridin-5-yl)-N-(5-(pyridazin-3-yl)pyridin-2-yl)acetamide
Database identifiers
- PubChem CID
- 46927367
- ChEMBL
CHEMBL5892163
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 93.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 5
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 570
Related reactions
3 records
Compound notes
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