Basic information
- CAS
88066-95-9- Standard SMILES
Cc1nnc2cnc(-c3ccccc3)cn12- InChIKey
PTGIYHJNEWXRKH-UHFFFAOYSA-N- Molecular formula
- C12H10N4
- Average molar mass
- 210.23 g/mol
- Monoisotopic mass
- 210.09054632
Names & identifiers
- Preferred name
- 3-Methyl-6-phenyl[1,2,4]triazolo[4,3-a]pyrazine
- IUPAC
- 3-methyl-6-phenyl-[1,2,4]triazolo[4,3-a]pyrazine
Names & synonyms
88066-95-93-Methyl-6-phenyl[1,2,4]triazolo[4,3-a]pyrazineSCHEMBL11136887DTXSID80526935PTGIYHJNEWXRKH-UHFFFAOYSA-N6-Phenyl-3-methyl-1,2,4-triazolo[4,3-a]pyrazine
Database identifiers
- CAS
88066-95-9- PubChem CID
- 13199874
- DTXSID
DTXSID80526935
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 43.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 239
Related reactions
1 records
Compound notes
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