Basic information
- Standard SMILES
CCCCNc1nccc(-c2c(-c3ccc(F)cc3)nn3c(-c4ccco4)cccc23)n1- InChIKey
XXUMHEXVTRQQTL-UHFFFAOYSA-N- Molecular formula
- C25H22FN5O
- Average molar mass
- 427.5 g/mol
- Monoisotopic mass
- 427.1808385
Names & identifiers
- Preferred name
- N-butyl-4-[2-(4-fluorophenyl)-7-(2-furyl)pyrazolo[1,5-a]pyridin-3-yl]pyrimidin-2-amine
- IUPAC
- N-butyl-4-[2-(4-fluorophenyl)-7-(furan-2-yl)pyrazolo[1,5-a]pyridin-3-yl]pyrimidin-2-amine
Names & synonyms
SCHEMBL5460483XXUMHEXVTRQQTL-UHFFFAOYSA-NN-butyl-4-[2-(4-fluorophenyl)-7-(2-furyl)pyrazolo[1,5-a]pyridin-3-yl]pyrimidin-2-amineN-butyl-4-[2-(4-fluorophenyl)-7-(2-furyl)pyrazolo[1,5-alpha]pyridin-3-yl]pyrimidin-2-amine
Database identifiers
- PubChem CID
- 10137347
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 68.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 589
Related reactions
1 records
Compound notes
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