Basic information
- CAS
2878-01-5- Standard SMILES
Nc1nc(N)c(N=Nc2ccccc2Cl)c(N)n1- InChIKey
YKYUQVGTVMQETN-UHFFFAOYSA-N- Molecular formula
- C10H10ClN7
- Average molar mass
- 263.69 g/mol
- Monoisotopic mass
- 263.068621
Names & identifiers
- Preferred name
- 5-(o-Chlorophenylazo)-2,4,6-triaminopyrimidine
- IUPAC
- 5-[(2-chlorophenyl)diazenyl]pyrimidine-2,4,6-triamine
Names & synonyms
PY-625-(o-Chlorophenylazo)-2,4,6-triaminopyrimidine2878-01-5Pyrimidine, 5-(o-chlorophenylazo)-2,4,6-triamino-SCHEMBL30439585
Database identifiers
- CAS
2878-01-5- PubChem CID
- 200860
- Nikkaji
- J85.930C
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 129 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 288
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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