Basic information
- Standard SMILES
CN(C)c1ccc(Nc2ncc(C(F)(F)F)c(Cl)n2)cc1- InChIKey
YCWDFBMSOFDYJZ-UHFFFAOYSA-N- Molecular formula
- C13H12ClF3N4
- Average molar mass
- 316.71 g/mol
Names & identifiers
- Preferred name
- N-(4-Chloro-5-trifluoromethyl-pyrimidin-2-yl)-N',N'-dimethyl-benzene-1,4-diamine
- IUPAC
- 1-N-[4-chloro-5-(trifluoromethyl)pyrimidin-2-yl]-4-N,4-N-dimethylbenzene-1,4-diamine
Names & synonyms
N-(4-Chloro-5-trifluoromethyl-pyrimidin-2-yl)-N',N'-dimethyl-benzene-1,4-diamineSCHEMBL5567919
Database identifiers
- PubChem CID
- 21923099
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 41.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 332
Related reactions
2 records
Compound notes
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