Basic information
- Standard SMILES
CCCS(=O)(=O)N1CCCC(NC(=O)Nc2cnc3c(ccn3COCC[Si](C)(C)C)n2)C1- InChIKey
WWMUWNQJOKDEDE-UHFFFAOYSA-N- Molecular formula
- C21H36N6O4SSi
- Average molar mass
- 496.7 g/mol
- Monoisotopic mass
- 496.22880136
Names & identifiers
- Preferred name
- 1-(1-Propylsulfonylpiperidin-3-yl)-3-[5-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyrazin-2-yl]urea
- IUPAC
- 1-(1-propylsulfonylpiperidin-3-yl)-3-[5-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyrazin-2-yl]urea
Names & synonyms
SCHEMBL2376797
Database identifiers
- PubChem CID
- 67385482
Properties
Computed structural properties
- Topological polar surface area
- 127 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 10
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 744
Related reactions
1 records
Compound notes
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