2-(Trifluoromethyl)-1h-imidazo[4,5-b]pyrazine
Basic information
- CAS
58885-00-0- Standard SMILES
FC(F)(F)c1nc2nccnc2[nH]1- InChIKey
YVWAGTSVIGRUAN-UHFFFAOYSA-N- Molecular formula
- C6H3F3N4
- Average molar mass
- 188.11 g/mol
- Monoisotopic mass
- 188.0309806
Names & identifiers
- Preferred name
- 2-(Trifluoromethyl)-1h-imidazo[4,5-b]pyrazine
- IUPAC
- 2-(trifluoromethyl)-1H-imidazo[4,5-b]pyrazine
Names & synonyms
2-(trifluoromethyl)-1h-imidazo[4,5-b]pyrazine58885-00-0MLS0031063552-(Trifluoromethyl)-4H-imidazo[4,5-b]pyrazineNSC151665CHEMBL2362554SCHEMBL20570034DTXSID70302503YVWAGTSVIGRUAN-UHFFFAOYSA-NNSC-151665SMR001821261
Database identifiers
- CAS
58885-00-0- PubChem CID
- 289503
- DTXSID
DTXSID70302503- ChEMBL
CHEMBL2362554
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 54.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 195
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Compound notes
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