Basic information
- Standard SMILES
CC(C)(C)OC(=O)N1CCC(n2nc(-c3cnc4c(n3)c(C=O)cn4COCC[Si](C)(C)C)c3ccc(F)cc32)CC1- InChIKey
VQMNHTUJMGNCBE-UHFFFAOYSA-N- Molecular formula
- C30H39FN6O4Si
- Average molar mass
- 594.8 g/mol
Names & identifiers
- Preferred name
- 4-{6-fluoro-3-[7-formyl-5-(2-trimethylsilanyl-ethoxymethyl)-5H-pyrrolo[2,3-b]pyrazin-2-yl]-indazol-1-yl}-piperidine-1-carboxylic acid tert-butyl ester
- IUPAC
- tert-butyl 4-[6-fluoro-3-[7-formyl-5-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyrazin-2-yl]indazol-1-yl]piperidine-1-carboxylate
Names & synonyms
SCHEMBL14737540VQMNHTUJMGNCBE-UHFFFAOYSA-N4-{6-fluoro-3-[7-formyl-5-(2-trimethylsilanyl-ethoxymethyl)-5H-pyrrolo[2,3-b]pyrazin-2-yl]-indazol-1-yl}-piperidine-1-carboxylic acid tert-butyl ester4-{6-fluoro-3-[7-formyl-5-(2-trimethylsilanylethoxymethyl)-5H-pyrrolo[2,3-b]pyrazin-2-yl]-indazol-1-yl}-piperidine-1-carboxylic acid tert-butyl ester
Database identifiers
- PubChem CID
- 86677972
Properties
Computed structural properties
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 10
- Heavy atoms
- 42
- Formal charge
- 0
- Complexity
- 942
Related reactions
2 records
Compound notes
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