1-{[(5-{3-chloro-4-[5-(trifluoromethyl)-1H-imidazol-2-yl]phenyl}-4-methylpyridin-2-yl)oxy]methyl}cyclobutanecarboxylic acid
Basic information
- Standard SMILES
Cc1cc(OCC2(C(=O)O)CCC2)ncc1-c1ccc(-c2ncc(C(F)(F)F)[nH]2)c(Cl)c1- InChIKey
HVNGEISZYWCFQQ-UHFFFAOYSA-N- Molecular formula
- C22H19ClF3N3O3
- Average molar mass
- 465.9 g/mol
Names & identifiers
- Preferred name
- 1-{[(5-{3-chloro-4-[5-(trifluoromethyl)-1H-imidazol-2-yl]phenyl}-4-methylpyridin-2-yl)oxy]methyl}cyclobutanecarboxylic acid
- IUPAC
- 1-[[5-[3-chloro-4-[5-(trifluoromethyl)-1H-imidazol-2-yl]phenyl]-4-methyl-2-pyridinyl]oxymethyl]cyclobutane-1-carboxylic acid
Names & synonyms
1-{[(5-{3-chloro-4-[5-(trifluoromethyl)-1H-imidazol-2-yl]phenyl}-4-methylpyridin-2-yl)oxy]methyl}cyclobutanecarboxylic acidSCHEMBL9940445CHEMBL3921484BDBM220986US9302996, 101-3
Database identifiers
- PubChem CID
- 57411331
- ChEMBL
CHEMBL3921484
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 88.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 6
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 679
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Related reactions
1 records
Compound notes
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