Basic information
- Standard SMILES
Cn1nc(-c2cnc3c(n2)c(C(=O)NC(C)(C)C)cn3COCC[Si](C)(C)C)c2c1CCCCC2- InChIKey
XBKPAGUKVTYTON-UHFFFAOYSA-N- Molecular formula
- C26H40N6O2Si
- Average molar mass
- 496.7 g/mol
- Monoisotopic mass
- 496.29820107
Names & identifiers
- Preferred name
- 2-(1-methyl-1,4,5,6,7,8-hexahydrocycloheptapyrazol-3-yl)-5-(2-trimethylsilanyl-ethoxymethyl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxylic acid tert-butylamide
- IUPAC
- N-tert-butyl-2-(1-methyl-5,6,7,8-tetrahydro-4H-cyclohepta[d]pyrazol-3-yl)-5-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyrazine-7-carboxamide
Names & synonyms
SCHEMBL14737093XBKPAGUKVTYTON-UHFFFAOYSA-N2-(1-methyl-1,4,5,6,7,8-hexahydrocycloheptapyrazol-3-yl)-5-(2-trimethylsilanyl-ethoxymethyl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxylic acid tert-butylamide
Database identifiers
- PubChem CID
- 71279441
Properties
Computed structural properties
- Topological polar surface area
- 86.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 726
Related reactions
2 records
Compound notes
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