Basic information
- CAS
121845-74-7- Standard SMILES
Cc1nnc2ccnc(C)c2n1- InChIKey
JKFHTFWIIMAUHR-UHFFFAOYSA-N- Molecular formula
- C8H8N4
- Average molar mass
- 160.18 g/mol
- Monoisotopic mass
- 160.07489627
Names & identifiers
- Preferred name
- 3,5-Dimethylpyrido[3,4-e][1,2,4]triazine
- IUPAC
- 3,5-dimethylpyrido[3,4-e][1,2,4]triazine
Names & synonyms
3,5-dimethylpyrido[3,4-e][1,2,4]triazine121845-74-73,5-Dimethyl-pyrido(3,4-e)(1,2,4)triazine3,5-Dimethyl-pyrido[3,4-e][1,2,4]triazineCHEMBL85271DTXSID60923983
Database identifiers
- CAS
121845-74-7- PubChem CID
- 516624
- DTXSID
DTXSID60923983- ChEMBL
CHEMBL85271- Nikkaji
- J239.886I
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 51.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 161
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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