Basic information
- Standard SMILES
C[Si](C)(C)CCOCn1ccc2c(-c3cnn(C4(CC#N)CC(CO)(CO)C4)c3)ncnc21- InChIKey
UYYBBWXPIKRQNU-UHFFFAOYSA-N- Molecular formula
- C23H32N6O3Si
- Average molar mass
- 468.6 g/mol
Names & identifiers
- Preferred name
- 3,3-bis(hydroxymethyl)-1-[4-(7-[2-(trimethylsilyl)ethoxy]methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrazol-1-yl]cyclobutylacetonitrile
- IUPAC
- 2-[3,3-bis(hydroxymethyl)-1-[4-[7-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-d]pyrimidin-4-yl]pyrazol-1-yl]cyclobutyl]acetonitrile
Names & synonyms
SCHEMBL1396245UYYBBWXPIKRQNU-UHFFFAOYSA-N3,3-bis(hydroxymethyl)-1-[4-(7-[2-(trimethylsilyl)ethoxy]methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrazol-1-yl]cyclobutylacetonitrile
Database identifiers
- PubChem CID
- 67017203
Properties
Computed structural properties
- Topological polar surface area
- 122 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 10
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 713
Related reactions
3 records
Compound notes
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