Basic information
- Standard SMILES
CC(=O)Nc1cc(Nc2cc(Nc3cn(C)cn3)n3ncc(C#N)c3n2)ccc1C- InChIKey
BVIIISKMMOOOPF-UHFFFAOYSA-N- Molecular formula
- C20H19N9O
- Average molar mass
- 401.4 g/mol
Names & identifiers
- Preferred name
- N-[5-({3-Cyano-7-[(1-Methyl-1h-Imidazol-4-Yl)amino]pyrazolo[1,5-A]pyrimidin-5-Yl}amino)-2-Methylphenyl]acetamide
- IUPAC
- N-[5-[[3-cyano-7-[(1-methylimidazol-4-yl)amino]pyrazolo[1,5-a]pyrimidin-5-yl]amino]-2-methylphenyl]acetamide
Names & synonyms
N-[5-({3-Cyano-7-[(1-Methyl-1h-Imidazol-4-Yl)amino]pyrazolo[1,5-A]pyrimidin-5-Yl}amino)-2-Methylphenyl]acetamideCHEMBL2409184Q27451531
Database identifiers
- PubChem CID
- 72164045
- ChEMBL
CHEMBL2409184
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 125 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 666
Related reactions
2 records
Compound notes
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