N5-(4-Fluorophenyl)-N6-[3-(trifluoromethyl)phenyl][1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine
Basic information
- CAS
392315-46-7- Standard SMILES
Fc1ccc(Nc2nc3nonc3nc2Nc2cccc(C(F)(F)F)c2)cc1- InChIKey
BINAUYXGNYHGCE-UHFFFAOYSA-N- Molecular formula
- C17H10F4N6O
- Average molar mass
- 390.29 g/mol
- Monoisotopic mass
- 390.08522161
Names & identifiers
- Preferred name
- N5-(4-Fluorophenyl)-N6-[3-(trifluoromethyl)phenyl][1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine
- IUPAC
- 6-N-(4-fluorophenyl)-5-N-[3-(trifluoromethyl)phenyl]-[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine
Names & synonyms
392315-46-7CHEMBL1355230DTXSID301118629HMS1850D16AKOS001521915NCGC00117664-01N5-(4-Fluorophenyl)-N6-[3-(trifluoromethyl)phenyl][1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamineSY527209ST50984627D268-0470{6-[(4-fluorophenyl)amino](1,2,5-oxadiazolo[3,4-e]pyrazin-5-yl)}[3-(trifluorom ethyl)phenyl]amineN~5~-(4-Fluorophenyl)-N~6~-[3-(trifluoromethyl)phenyl][1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine
Show more names
N5-(4-FLUOROPHENYL)-N6-[3-(TRIFLUOROMETHYL)PHENYL]-[1,2,5]OXADIAZOLO[3,4-B]PYRAZINE-5,6-DIAMINE
Database identifiers
- CAS
392315-46-7- PubChem CID
- 4377992
- DTXSID
DTXSID301118629- ChEMBL
CHEMBL1355230
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 88.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 4
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 518
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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