Basic information
- Standard SMILES
O=C(NC1CCCCC1C(=O)O)NC(Cc1ccccc1)(c1cc(F)cc(OC(F)(F)C(F)F)c1)c1ccc(Cl)cn1- InChIKey
IXCDMVLEHRUUON-UHFFFAOYSA-N- Molecular formula
- C29H27ClF5N3O4
- Average molar mass
- 612 g/mol
- Monoisotopic mass
- 611.1610249
Names & identifiers
- IUPAC
- 2-[[1-(5-chloro-2-pyridinyl)-1-[3-fluoro-5-(1,1,2,2-tetrafluoroethoxy)phenyl]-2-phenylethyl]carbamoylamino]cyclohexane-1-carboxylic acid
Database identifiers
- PubChem CID
- 72463421
Properties
Computed structural properties
- XLogP
- 7.2
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 10
- Heavy atoms
- 42
- Formal charge
- 0
- Complexity
- 914
Related reactions
1 records
Compound notes
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