Basic information
- CAS
13491-72-0- Standard SMILES
Nc1nc(N)c(N)c(-c2ccccc2)n1- InChIKey
DQNNVEUCALFYGS-UHFFFAOYSA-N- Molecular formula
- C10H11N5
- Average molar mass
- 201.23 g/mol
- Monoisotopic mass
- 201.10144537
Names & identifiers
- Preferred name
- 6-Phenylpyrimidine-2,4,5-triamine
- IUPAC
- 6-phenylpyrimidine-2,4,5-triamine
Names & synonyms
6-phenylpyrimidine-2,4,5-triamine13491-72-0NSC101561NCIOpen2_007033SCHEMBL16463518DTXSID20295370NSC-101561
Database identifiers
- CAS
13491-72-0- PubChem CID
- 265484
- DTXSID
DTXSID20295370
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 204
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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