Basic information
- Standard SMILES
Cn1cc(-c2cc3nccn3c(-c3cnn(C4(CC#N)CN(c5ncccn5)C4)c3)n2)cn1- InChIKey
KLEQDDTYZUJJSI-UHFFFAOYSA-N- Molecular formula
- C22H19N11
- Average molar mass
- 437.5 g/mol
Names & identifiers
- Preferred name
- 2-(3-(4-(7-(1-methyl-1H-pyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-yl)-1H-pyrazol-1-yl)-1-(pyrimidin-2-yl)azetidin-3-yl)acetonitrile
- IUPAC
- 2-[3-[4-[7-(1-methylpyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-yl]pyrazol-1-yl]-1-pyrimidin-2-ylazetidin-3-yl]acetonitrile
Names & synonyms
SCHEMBL2574712KLEQDDTYZUJJSI-UHFFFAOYSA-N2-(3-(4-(7-(1-methyl-1H-pyrazol-4-yl)imidazo[1,2-c]pyrimidin-5-yl)-1H-pyrazol-1-yl)-1-(pyrimidin-2-yl)azetidin-3-yl)acetonitrile
Database identifiers
- PubChem CID
- 67458317
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 119 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 5
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 742
Related reactions
1 records
Compound notes
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