Basic information
- CAS
30354-93-9- Standard SMILES
Nc1nc(N)nc(-c2cccc3ccccc23)n1- InChIKey
DGSDSNFYFZZPLY-UHFFFAOYSA-N- Molecular formula
- C13H11N5
- Average molar mass
- 237.26 g/mol
- Monoisotopic mass
- 237.10144537
Names & identifiers
- Preferred name
- 6-(1-Naphthyl)-s-triazine-2,4-diamine
- IUPAC
- 6-naphthalen-1-yl-1,3,5-triazine-2,4-diamine
Names & synonyms
ST5101038030354-93-96-(1-Naphthyl)-s-triazine-2,4-diamine6-(naphthalen-1-yl)-1,3,5-triazine-2,4-diamineSCHEMBL2254648DTXSID50275120AKOS0243726046-naphthyl-1,3,5-triazine-2,4-diamine
Database identifiers
- CAS
30354-93-9- PubChem CID
- 34922
- DTXSID
DTXSID50275120- Nikkaji
- J1.611.564I
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 90.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 275
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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