Basic information
- Standard SMILES
Cc1c(C(=O)N[C@@H]2CCCC[C@H]2O)cc(-c2cc(C(F)(F)F)ccc2Cl)n1C[C@@]1(C)CCCO1- InChIKey
LIJCRYAZSRIYHG-KIFXHHALSA-N- Molecular formula
- C25H30ClF3N2O3
- Average molar mass
- 499 g/mol
- Monoisotopic mass
- 498.189705
Names & identifiers
- Preferred name
- 5-(2-Chloro-5-trifluoromethyl-phenyl)-2-methyl-1-((R)-2-methyl-tetrahydro-furan-2-ylmethyl)-1H-pyrrole-3-carboxylic acid ((1R,2R)-2-hydroxy-cyclohexyl)-amide
- IUPAC
- 5-[2-chloro-5-(trifluoromethyl)phenyl]-N-[(1R,2R)-2-hydroxycyclohexyl]-2-methyl-1-[[(2R)-2-methyloxolan-2-yl]methyl]pyrrole-3-carboxamide
Names & synonyms
5-(2-Chloro-5-trifluoromethyl-phenyl)-2-methyl-1-((R)-2-methyl-tetrahydro-furan-2-ylmethyl)-1H-pyrrole-3-carboxylic acid ((1R,2R)-2-hydroxy-cyclohexyl)-amide
Database identifiers
- PubChem CID
- 11656248
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 63.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 726
Related reactions
1 records
Compound notes
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