Basic information
- Standard SMILES
Cc1ccc(NC(=O)[C@H](COCCO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)Oc2ncnc3c2cnn3-c2c(Cl)cccc2C#N)nc1- InChIKey
LLLNRPXJKQTDNT-XIFFEERXSA-N- Molecular formula
- C39H38ClN7O4Si
- Average molar mass
- 732.3 g/mol
- Monoisotopic mass
- 731.2443069
Names & identifiers
- Preferred name
- (2S)-3-(2-(tert-butyldiphenylsilyloxy)ethoxy)-2-(1-(2-chloro-6-cyanophenyl)-1H-pyrazolo [3,4-d]pyrimidin-4-yloxy)-N-(5-methylpyridin-2-yl)propanamide
- IUPAC
- (2S)-3-[2-[tert-butyl(diphenyl)silyl]oxyethoxy]-2-[1-(2-chloro-6-cyanophenyl)pyrazolo[5,4-d]pyrimidin-4-yl]oxy-N-(5-methyl-2-pyridinyl)propanamide
Names & synonyms
SCHEMBL839623LLLNRPXJKQTDNT-XIFFEERXSA-N(2S)-3-(2-(tert-butyldiphenylsilyloxy)ethoxy)-2-(1-(2-chloro-6-cyanophenyl)-1H-pyrazolo [3,4-d]pyrimidin-4-yloxy)-N-(5-methylpyridin-2-yl)propanamide(2S)-3-(2-(tert-butyldiphenylsilyloxy)ethoxy)-2-(1-(2-chloro-6-cyanophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yloxy)-N-(5-methylpyridin-2-yl)propanamide
Database identifiers
- PubChem CID
- 57504530
Properties
Computed structural properties
- Topological polar surface area
- 137 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 14
- Heavy atoms
- 52
- Formal charge
- 0
- Complexity
- 1,170
Related reactions
2 records
Compound notes
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