2-(2-(2-(2-((4-(Piperidin-4-yl)phenyl)amino)-5-(trifluoromethyl)pyrimidin-4-yl)ethyl)phenyl)butanamide
Completing data — refresh the page later to see the latest
Basic information
- Standard SMILES
CCC(C(N)=O)c1ccccc1CCc1nc(Nc2ccc(C3CCNCC3)cc2)ncc1C(F)(F)F- InChIKey
MVRXYLMTEFAMSR-UHFFFAOYSA-N- Molecular formula
- C28H32F3N5O
- Average molar mass
- 511.6 g/mol
- Monoisotopic mass
- 511.25589515
Names & identifiers
- Preferred name
- 2-(2-(2-(2-((4-(Piperidin-4-yl)phenyl)amino)-5-(trifluoromethyl)pyrimidin-4-yl)ethyl)phenyl)butanamide
- IUPAC
- 2-[2-[2-[2-(4-piperidin-4-ylanilino)-5-(trifluoromethyl)pyrimidin-4-yl]ethyl]phenyl]butanamide
Names & synonyms
2-(2-(2-(2-((4-(Piperidin-4-yl)phenyl)amino)-5-(trifluoromethyl)pyrimidin-4-yl)ethyl)phenyl)butanamideCHEMBL3946227SCHEMBL15502365BDBM202392US9238644, 1
Database identifiers
- PubChem CID
- 73296286
- ChEMBL
CHEMBL3946227
Properties
Computed structural propertiesFilling in
- XLogP
- 5.1
- Topological polar surface area
- 92.9 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 9
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 708
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
1 records
Compound notes
Loading…