Basic information
- Standard SMILES
Cc1c(C)n(Cc2ccc(-c3ccccc3C(=O)O)cc2)c2ccc(C(=O)N[C@@H](C)c3cccc(C(F)(F)F)c3)cc12- InChIKey
CZVKLWAQRUDGMY-NRFANRHFSA-N- Molecular formula
- C34H29F3N2O3
- Average molar mass
- 570.6 g/mol
Names & identifiers
- Preferred name
- (S)-4'-((2,3-dimethyl-5-((1-(3-(trifluoromethyl)phenyl)ethyl)carbamoyl)-1H-indol-1-yl)methyl)-[1,1'-biphenyl]-2-carboxylic acid
- IUPAC
- 2-[4-[[2,3-dimethyl-5-[[(1S)-1-[3-(trifluoromethyl)phenyl]ethyl]carbamoyl]indol-1-yl]methyl]phenyl]benzoic acid
Names & synonyms
CHEMBL3735765(S)-4'-((2,3-dimethyl-5-((1-(3-(trifluoromethyl)phenyl)ethyl)carbamoyl)-1H-indol-1-yl)methyl)-[1,1'-biphenyl]-2-carboxylic acidSCHEMBL14120613BDBM50498896
Database identifiers
- PubChem CID
- 53389239
- ChEMBL
CHEMBL3735765
Properties
Computed structural properties
- XLogP
- 7.6
- Topological polar surface area
- 71.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 42
- Formal charge
- 0
- Complexity
- 935
Related reactions
1 records
Compound notes
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