5-Phenyl-[1,2,5]oxadiazolo[3,4-b]pyrazine
Basic information
- CAS
64163-29-7- Standard SMILES
c1ccc(-c2cnc3nonc3n2)cc1- InChIKey
KPFDAMGPOMPFJC-UHFFFAOYSA-N- Molecular formula
- C10H6N4O
- Average molar mass
- 198.18 g/mol
- Monoisotopic mass
- 198.05416083
Names & identifiers
- Preferred name
- 5-Phenyl-[1,2,5]oxadiazolo[3,4-b]pyrazine
- IUPAC
- 5-phenyl-[1,2,5]oxadiazolo[3,4-b]pyrazine
Names & synonyms
5-phenyl-[1,2,5]oxadiazolo[3,4-b]pyrazine64163-29-75-Phenyl[1,2,5]oxadiazolo[3,4-b]pyrazineHMS1534K13[1,2,5]Oxadiazolo[3,4-b]pyrazine, phenyl-TimTec1_000233CHEMBL4568201SCHEMBL122103115-phenylfurazano[3,4-b]pyrazineDTXSID20343209KPFDAMGPOMPFJC-UHFFFAOYSA-NHTS26435
Show more names
STL360310AKOS001704807Furazano[3,4-b]pyrazine, 5-phenyl-NCGC00175334-01ST0005725-phenyl-1,2,5-oxadiazolo[3,4-b]pyrazineCS-0360853EU-0050876
Database identifiers
- CAS
64163-29-7- PubChem CID
- 588207
- DTXSID
DTXSID20343209- ChEMBL
CHEMBL4568201- Nikkaji
- J3.456.562G
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 64.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 219
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Compound notes
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