Basic information
- Standard SMILES
CCCN(c1ccccc1)c1nc(C)nc(Cl)c1[N+](=O)[O-]- InChIKey
GXIXHFQBKWIETB-UHFFFAOYSA-N- Molecular formula
- C14H15ClN4O2
- Average molar mass
- 306.75 g/mol
Names & identifiers
- Preferred name
- 6-chloro-2-methyl-5-nitro-N-phenyl-N-propylpyrimidin-4-amine
- IUPAC
- 6-chloro-2-methyl-5-nitro-N-phenyl-N-propylpyrimidin-4-amine
Names & synonyms
SCHEMBL9124230
Database identifiers
- PubChem CID
- 15225129
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 74.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 346
Related reactions
2 records
Compound notes
Loading…