1-Propyl-8-(1H-pyrazol-4-yl)-2-pyrrolidin-1-yl-7-(2-trimethylsilanyl-ethoxymethyl)-1,7-dihydro-purin-6-one
Basic information
- Standard SMILES
CCCn1c(N2CCCC2)nc2nc(-c3cn[nH]c3)n(COCC[Si](C)(C)C)c2c1=O- InChIKey
UQAUCNGQSPRHEK-UHFFFAOYSA-N- Molecular formula
- C21H33N7O2Si
- Average molar mass
- 443.6 g/mol
- Monoisotopic mass
- 443.24649986
Names & identifiers
- Preferred name
- 1-Propyl-8-(1H-pyrazol-4-yl)-2-pyrrolidin-1-yl-7-(2-trimethylsilanyl-ethoxymethyl)-1,7-dihydro-purin-6-one
- IUPAC
- 1-propyl-8-(1H-pyrazol-4-yl)-2-pyrrolidin-1-yl-7-(2-trimethylsilylethoxymethyl)purin-6-one
Names & synonyms
SCHEMBL1724878UQAUCNGQSPRHEK-UHFFFAOYSA-N1-Propyl-8-(1H-pyrazol-4-yl)-2-pyrrolidin-1-yl-7-(2-trimethylsilanyl-ethoxymethyl)-1,7-dihydro-purin-6-one
Database identifiers
- PubChem CID
- 67135151
Properties
Computed structural properties
- Topological polar surface area
- 91.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 665
Related reactions
4 records
Compound notes
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