5-Bromo-6-{4-[4-(4-fluoro-3-trifluoromethyl-phenyl)-1-(2-piperidin-1-yl-ethyl)-1H-imidazol-2-yl]-piperidin-1-yl}-pyrimidin-4-ylamine
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Basic information
- Standard SMILES
Nc1ncnc(N2CCC(c3nc(-c4ccc(F)c(C(F)(F)F)c4)cn3CCN3CCCCC3)CC2)c1Br- InChIKey
VUVBORUFCYIRBE-UHFFFAOYSA-N- Molecular formula
- C26H30BrF4N7
- Average molar mass
- 596.5 g/mol
Names & identifiers
- Preferred name
- 5-Bromo-6-{4-[4-(4-fluoro-3-trifluoromethyl-phenyl)-1-(2-piperidin-1-yl-ethyl)-1H-imidazol-2-yl]-piperidin-1-yl}-pyrimidin-4-ylamine
- IUPAC
- 5-bromo-6-[4-[4-[4-fluoro-3-(trifluoromethyl)phenyl]-1-(2-piperidin-1-ylethyl)imidazol-2-yl]piperidin-1-yl]pyrimidin-4-amine
Names & synonyms
5-Bromo-6-{4-[4-(4-fluoro-3-trifluoromethyl-phenyl)-1-(2-piperidin-1-yl-ethyl)-1H-imidazol-2-yl]-piperidin-1-yl}-pyrimidin-4-ylamineCHEMBL3956468SCHEMBL14782413BDBM182360US9145392, 61
Database identifiers
- PubChem CID
- 89442602
- ChEMBL
CHEMBL3956468
Properties
Computed structural propertiesFilling in
- XLogP
- 4.8
- Topological polar surface area
- 76.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 6
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 750
Related reactions
1 records
Compound notes
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