Basic information
- Standard SMILES
Cc1ccc(C)c(CC(=O)N2CCc3cc(-c4nn(C)c5ncnc(N)c45)ccc32)c1- InChIKey
CDYXNHLXTXSSEX-UHFFFAOYSA-N- Molecular formula
- C24H24N6O
- Average molar mass
- 412.5 g/mol
Names & identifiers
- Preferred name
- 3-{1-[(2,5-dimethylphenyl)acetyl]-2,3-dihydro-1H-indol-5-yl}-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine
- IUPAC
- 1-[5-(4-amino-1-methylpyrazolo[3,4-d]pyrimidin-3-yl)-2,3-dihydroindol-1-yl]-2-(2,5-dimethylphenyl)ethanone
Names & synonyms
SCHEMBL869034CDYXNHLXTXSSEX-UHFFFAOYSA-N3-{1-[(2,5-dimethylphenyl)acetyl]-2,3-dihydro-1H-indol-5-yl}-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine
Database identifiers
- PubChem CID
- 53377568
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 89.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 660
Related reactions
1 records
Compound notes
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