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Basic information
- Standard SMILES
COc1cc(Nc2nccc(Oc3c(Cl)cccc3Cl)n2)ccc1-n1cnc(C)c1- InChIKey
CYPHNDGOTIMHCR-UHFFFAOYSA-N- Molecular formula
- C21H17Cl2N5O2
- Average molar mass
- 442.3 g/mol
- Monoisotopic mass
- 441.0759302
Names & identifiers
- Preferred name
- [4-(2,6-Dichloro-phenoxy)-pyrimidin-2-yl]-[3-methoxy-4-(4-methyl-imidazol-1-yl)-phenyl]-amine
- IUPAC
- 4-(2,6-dichlorophenoxy)-N-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]pyrimidin-2-amine
Names & synonyms
SCHEMBL4090918CYPHNDGOTIMHCR-UHFFFAOYSA-N[4-(2,6-Dichloro-phenoxy)-pyrimidin-2-yl]-[3-methoxy-4-(4-methyl-imidazol-1-yl)-phenyl]-amine
Database identifiers
- PubChem CID
- 44192599
Properties
Computed structural propertiesFilling in
- XLogP
- 5.3
- Topological polar surface area
- 74.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 538
Related reactions
1 records
Compound notes
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