3-((7-(Cyclopropylamino)-3-formylpyrazolo[1,5-a]pyrimidin-5-yl)methyl)benzonitrile
Completing data — refresh the page later to see the latest
Basic information
- Standard SMILES
N#Cc1cccc(Cc2cc(NC3CC3)n3ncc(C=O)c3n2)c1- InChIKey
LFUQYBKAEBUQRD-UHFFFAOYSA-N- Molecular formula
- C18H15N5O
- Average molar mass
- 317.3 g/mol
- Monoisotopic mass
- 317.12766012
Names & identifiers
- Preferred name
- 3-((7-(Cyclopropylamino)-3-formylpyrazolo[1,5-a]pyrimidin-5-yl)methyl)benzonitrile
- IUPAC
- 3-[[7-(cyclopropylamino)-3-formylpyrazolo[1,5-a]pyrimidin-5-yl]methyl]benzonitrile
Names & synonyms
SCHEMBL1934003LFUQYBKAEBUQRD-UHFFFAOYSA-N3-((7-(cyclopropylamino)-3-formylpyrazolo[1,5-a]pyrimidin-5-yl)methyl)benzonitrile
Database identifiers
- PubChem CID
- 58314616
Properties
Computed structural propertiesFilling in
- XLogP
- 2.3
- Topological polar surface area
- 83.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 513
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
4 records
Compound notes
Loading…