Basic information
- CAS
91329-52-1- Standard SMILES
Nc1nc(Cl)cc(Nc2cccc(Cl)c2)n1- InChIKey
CEINFXADNGPZDT-UHFFFAOYSA-N- Molecular formula
- C10H8Cl2N4
- Average molar mass
- 255.1 g/mol
- Monoisotopic mass
- 254.0126017
Names & identifiers
- Preferred name
- 6-chloro-4-N-(3-chlorophenyl)pyrimidine-2,4-diamine
- IUPAC
- 6-chloro-4-N-(3-chlorophenyl)pyrimidine-2,4-diamine
Names & synonyms
91329-52-16-chloro-4-N-(3-chlorophenyl)pyrimidine-2,4-diamineNSC44188DTXSID40286205NSC-44188AKOS0174652936-Chloro-N~4~-(3-chlorophenyl)pyrimidine-2,4-diamine
Database identifiers
- CAS
91329-52-1- PubChem CID
- 239267
- DTXSID
DTXSID40286205
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 63.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 229
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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