Basic information
- Standard SMILES
O=C(NOC[C@H](O)CO)c1ccncc1Nc1ccc(I)cc1F- InChIKey
RKLLGCYJVHTWGA-SNVBAGLBSA-N- Molecular formula
- C15H15FIN3O4
- Average molar mass
- 447.2 g/mol
Names & identifiers
- Preferred name
- N-{[(2R)-2,3-dihydroxypropyl]oxy}-3-[(2-fluoro-4-iodophenyl)-amino]isonicotin-amide
- IUPAC
- N-[(2R)-2,3-dihydroxypropoxy]-3-(2-fluoro-4-iodoanilino)pyridine-4-carboxamide
Names & synonyms
SCHEMBL2024962RKLLGCYJVHTWGA-SNVBAGLBSA-NN-{[(2R)-2,3-dihydroxypropyl]oxy}-3-[(2-fluoro-4-iodophenyl)-amino]isonicotin-amide
Database identifiers
- PubChem CID
- 11640893
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 407
Related reactions
4 records
Compound notes
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