1,2,4-Triazolo(4,3-b)(1,2,4)triazine, 6,7-diphenyl-
Basic information
- CAS
37160-06-8- Standard SMILES
c1ccc(-c2nc3nncn3nc2-c2ccccc2)cc1- InChIKey
IGAUVIZYYOFFHR-UHFFFAOYSA-N- Molecular formula
- C16H11N5
- Average molar mass
- 273.29 g/mol
- Monoisotopic mass
- 273.10144537
Names & identifiers
- Preferred name
- 1,2,4-Triazolo(4,3-b)(1,2,4)triazine, 6,7-diphenyl-
- IUPAC
- 6,7-diphenyl-[1,2,4]triazolo[4,3-b][1,2,4]triazine
Names & synonyms
37160-06-81,2,4-Triazolo(4,3-b)(1,2,4)triazine, 6,7-diphenyl-6,7-Diphenyl-1,2,4-triazolo(4,3-b)(1,2,4)triazineDTXSID70190644NSC 149021RefChem:215224DTXCID101131356,7-diphenyl-[1,2,4]triazolo[4,3-b][1,2,4]triazineNSC1490216,7-diphenyl[1,2,4]triazolo[4,3-b][1,2,4]triazineOprea1_864629NSC-149021
Database identifiers
- CAS
37160-06-8- PubChem CID
- 98576
- DTXSID
DTXSID70190644
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 56 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 338
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Compound notes
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