Basic information
- Standard SMILES
C[C@H](Nc1ncnn2ccnc12)c1nc2ccc(F)cc2n1-c1ccccc1- InChIKey
BRBZUNIELFBMOX-ZDUSSCGKSA-N- Molecular formula
- C20H16FN7
- Average molar mass
- 373.4 g/mol
- Monoisotopic mass
- 373.1451217
Names & identifiers
- Preferred name
- [(S)-1-(6-Fluoro-1-phenyl-1H-benzoimidazol-2-yl)-ethyl]-imidazo[2,1-f][1,2,4]triazin-4-yl-amine
- IUPAC
- N-[(1S)-1-(6-fluoro-1-phenylbenzimidazol-2-yl)ethyl]imidazo[2,1-f][1,2,4]triazin-4-amine
Names & synonyms
SCHEMBL11901896BRBZUNIELFBMOX-ZDUSSCGKSA-N[(S)-1-(6-Fluoro-1-phenyl-1H-benzoimidazol-2-yl)-ethyl]-imidazo[2,1-f][1,2,4]triazin-4-yl-amine
Database identifiers
- PubChem CID
- 68158019
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 72.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 531
Related reactions
1 records
Compound notes
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