Basic information
- Standard SMILES
COc1cc(Nc2ncc3c(C)nc(-c4ccccc4Br)n3n2)cc(OC)c1OC- InChIKey
UNCFEUIRUGJPNL-UHFFFAOYSA-N- Molecular formula
- C21H20BrN5O3
- Average molar mass
- 470.3 g/mol
Names & identifiers
- Preferred name
- 7-(2-bromophenyl)-5-methyl-N-(3,4,5-trimethoxyphenyl)imidazo[5,1-f][1,2,4]triazin-2-amine
- IUPAC
- 7-(2-bromophenyl)-5-methyl-N-(3,4,5-trimethoxyphenyl)imidazo[5,1-f][1,2,4]triazin-2-amine
Names & synonyms
CHEMBL518916SCHEMBL3994431UNCFEUIRUGJPNL-UHFFFAOYSA-NBDBM502757017-(2-bromophenyl)-5-methyl-N-(3,4,5-trimethoxyphenyl)imidazo[1,5-f][1,2,4]triazin-2-amine7-(2-bromophenyl)-5-methyl-N-(3,4,5-trimethoxyphenyl)imidazo[5,1-f][1,2,4]triazin-2-amine
Database identifiers
- PubChem CID
- 11294348
- ChEMBL
CHEMBL518916
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 82.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 547
Related reactions
1 records
Compound notes
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