Basic information
- Standard SMILES
CCc1nc(N[C@@H]2COC[C@H]2O)c(CC)nc1Br- InChIKey
IFHYNPCFWYIYAE-NXEZZACHSA-N- Molecular formula
- C12H18BrN3O2
- Average molar mass
- 316.19 g/mol
Names & identifiers
- Preferred name
- trans-(+/-)-4-[(5-Bromo-3,6-diethylpyrazin-2-yl)amino]tetrahydrofuran-3-ol
- IUPAC
- (3S,4R)-4-[(5-bromo-3,6-diethylpyrazin-2-yl)amino]oxolan-3-ol
Names & synonyms
IFHYNPCFWYIYAE-NXEZZACHSA-Ntrans-(+/-)-4-[(5-bromo-3,6-diethylpyrazin-2-yl)amino]tetrahydrofuran-3-ol
Database identifiers
- PubChem CID
- 86588872
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 67.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 270
Related reactions
4 records
Compound notes
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