4,7-Diphenylpyrazolo[5,1-c][1,2,4]triazine
Basic information
- CAS
66612-81-5- Standard SMILES
c1ccc(-c2cc3nncc(-c4ccccc4)n3n2)cc1- InChIKey
HUSQZJSDOZCVPF-UHFFFAOYSA-N- Molecular formula
- C17H12N4
- Average molar mass
- 272.3 g/mol
- Monoisotopic mass
- 272.1061964
Names & identifiers
- Preferred name
- 4,7-Diphenylpyrazolo[5,1-c][1,2,4]triazine
- IUPAC
- 4,7-diphenylpyrazolo[5,1-c][1,2,4]triazine
Names & synonyms
66612-81-54,7-diphenylpyrazolo[5,1-c][1,2,4]triazineNSC3551684,1-c][1,2,4]triazineDTXSID00320119NSC-355168
Database identifiers
- CAS
66612-81-5- PubChem CID
- 337391
- DTXSID
DTXSID00320119
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 43.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 336
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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