Basic information
- Standard SMILES
CCc1nc(NC2c3cc(OC)ccc3CC2CC)c(CC)nc1Br- InChIKey
YIMSNDINRFVVAP-UHFFFAOYSA-N- Molecular formula
- C20H26BrN3O
- Average molar mass
- 404.3 g/mol
Names & identifiers
- Preferred name
- 5-bromo-3,6-diethyl-N-(2-ethyl-6-methoxy-2,3-dihydro-1H-inden-1-yl)pyrazin-2-amine
- IUPAC
- 5-bromo-3,6-diethyl-N-(2-ethyl-6-methoxy-2,3-dihydro-1H-inden-1-yl)pyrazin-2-amine
Names & synonyms
SCHEMBL3842866
Database identifiers
- PubChem CID
- 22147309
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 47 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 424
Related reactions
2 records
Compound notes
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