Basic information
- CAS
6301-28-6- Standard SMILES
Cc1cc(Nc2ccccc2Cl)nc(N)n1- InChIKey
SFBNWGSZNMAJTK-UHFFFAOYSA-N- Molecular formula
- C11H11ClN4
- Average molar mass
- 234.68 g/mol
- Monoisotopic mass
- 234.0672241
Names & identifiers
- Preferred name
- 4-N-(2-chlorophenyl)-6-methylpyrimidine-2,4-diamine
- IUPAC
- 4-N-(2-chlorophenyl)-6-methylpyrimidine-2,4-diamine
Names & synonyms
6301-28-6NSC44189DTXSID20978898NSC-44189AKOS015937976N-(2-chlorophenyl)-6-methylpyrimidine-2,4-diamineN~4~-(2-Chlorophenyl)-6-methylpyrimidine-2,4(1H,3H)-diimine
Database identifiers
- CAS
6301-28-6- PubChem CID
- 239268
- DTXSID
DTXSID20978898
Properties
Computed structural properties
- XLogP
- 2.8
- 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
- 226
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…