Basic information
- CAS
87209-05-0- Standard SMILES
c1ccc(-c2nnc(-c3ccc4ccc5cccnc5c4n3)nc2-c2ccccc2)cc1- InChIKey
SXWRNOVVJVTGGD-UHFFFAOYSA-N- Molecular formula
- C27H17N5
- Average molar mass
- 411.5 g/mol
- Monoisotopic mass
- 411.14839556
Names & identifiers
- Preferred name
- 2-(5,6-Diphenyl-1,2,4-triazin-3-yl)-1,10-phenanthroline
- IUPAC
- 2-(5,6-diphenyl-1,2,4-triazin-3-yl)-1,10-phenanthroline
Names & synonyms
2-(5,6-diphenyl-1,2,4-triazin-3-yl)-1,10-phenanthroline87209-05-0DTXSID80311388RefChem:252860DTXCID90262514NSC242687NSC-2426873-(1,10-phenanthrolin-2-yl)-5,6-diphenyl-1,2,4-triazine
Database identifiers
- CAS
87209-05-0- PubChem CID
- 315909
- DTXSID
DTXSID80311388- Nikkaji
- J1.489.931F
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 64.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 601
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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