Basic information
- Standard SMILES
O=C(O)c1cccnc1-c1ccn(C(=O)Nc2cc(F)cc(F)c2)n1- InChIKey
HEJKBDNLSZXQKD-UHFFFAOYSA-N- Molecular formula
- C16H10F2N4O3
- Average molar mass
- 344.27 g/mol
Names & identifiers
- Preferred name
- 2-[1-[(3,5-Difluorophenyl)carbamoyl]pyrazol-3-yl]pyridine-3-carboxylic acid
- IUPAC
- 2-[1-[(3,5-difluorophenyl)carbamoyl]pyrazol-3-yl]pyridine-3-carboxylic acid
Database identifiers
- PubChem CID
- 22908692
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 97.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 3
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 500
Related reactions
1 records
Compound notes
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