Basic information
- Standard SMILES
N#Cc1cc(CN2CCCC3(COC3)C2)c(Cl)c(Nc2nc(NC3CC3)c3ncc(C#N)n3n2)c1- InChIKey
JWPVNHIXECNQER-UHFFFAOYSA-N- Molecular formula
- C24H24ClN9O
- Average molar mass
- 490 g/mol
- Monoisotopic mass
- 489.1792341
Names & identifiers
- Preferred name
- 2-((3-(2-Oxa-6-azaspiro[3.5]nonan-6-ylmethyl)-2-chloro-5-cyanophenyl)amino)-4-(cyclopropylamino)imidazo[2,1-f][1,2,4]triazine-7-carbonitrile
- IUPAC
- 2-[2-chloro-5-cyano-3-(2-oxa-8-azaspiro[3.5]nonan-8-ylmethyl)anilino]-4-(cyclopropylamino)imidazo[2,1-f][1,2,4]triazine-7-carbonitrile
Names & synonyms
SCHEMBL15429424JWPVNHIXECNQER-UHFFFAOYSA-N2-((3-(2-oxa-6-azaspiro[3.5]nonan-6-ylmethyl)-2-chloro-5-cyanophenyl)amino)-4-(cyclopropylamino)imidazo[2,1-f][1,2,4]triazine-7-carbonitrile
Database identifiers
- PubChem CID
- 89934058
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 127 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 6
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 879
Related reactions
1 records
Compound notes
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