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Basic information
- Standard SMILES
Fc1ccc(CNc2cc(Cl)nc(Cl)n2)c(F)c1- InChIKey
POAXISOONGXBOO-UHFFFAOYSA-N- Molecular formula
- C11H7Cl2F2N3
- Average molar mass
- 290.09 g/mol
- Monoisotopic mass
- 288.9985089
Names & identifiers
- Preferred name
- (2,6-Dichloro-pyrimidin-4-yl)-(2,4-difluoro-benzyl)-amine
- IUPAC
- 2,6-dichloro-N-[(2,4-difluorophenyl)methyl]pyrimidin-4-amine
Names & synonyms
SCHEMBL14486380POAXISOONGXBOO-UHFFFAOYSA-N(2,6-Dichloro-pyrimidin-4-yl)-(2,4-difluoro-benzyl)-amine
Database identifiers
- PubChem CID
- 89350889
Properties
Computed structural propertiesFilling in
- XLogP
- 4.1
- Topological polar surface area
- 37.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 273
Related reactions
2 records
Compound notes
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