Basic information
- CAS
28731-85-3- Standard SMILES
Nc1ccc(Nc2nc(Cl)nc(Nc3ccc(N)cc3)n2)cc1- InChIKey
VYQUSHGMNCPSNC-UHFFFAOYSA-N- Molecular formula
- C15H14ClN7
- Average molar mass
- 327.77 g/mol
- Monoisotopic mass
- 327.0999212
Names & identifiers
- Preferred name
- 2-N,4-N-bis(4-aminophenyl)-6-chloro-1,3,5-triazine-2,4-diamine
- IUPAC
- 2-N,4-N-bis(4-aminophenyl)-6-chloro-1,3,5-triazine-2,4-diamine
Names & synonyms
28731-85-3NSC364211NSC-364211
Database identifiers
- CAS
28731-85-3- PubChem CID
- 339149
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 115 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 324
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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