5-(2-Chloro-5-trifluoromethyl-phenyl)-1-((1RS,2RS)-2-hydroxy-cyclohexylmethyl)-2-methyl-1H-pyrrole-3-carboxylic acid cyclohexylamide

HCID 10074576

Basic information

Standard SMILES
Cc1c(C(=O)NC2CCCCC2)cc(-c2cc(C(F)(F)F)ccc2Cl)n1CC1CCCCC1O
InChIKey
NBUOUESZGOJHIJ-UHFFFAOYSA-N
Molecular formula
C26H32ClF3N2O2
Average molar mass
497 g/mol
Monoisotopic mass
496.2104404

Names & identifiers

Preferred name
5-(2-Chloro-5-trifluoromethyl-phenyl)-1-((1RS,2RS)-2-hydroxy-cyclohexylmethyl)-2-methyl-1H-pyrrole-3-carboxylic acid cyclohexylamide
IUPAC
5-[2-chloro-5-(trifluoromethyl)phenyl]-N-cyclohexyl-1-[(2-hydroxycyclohexyl)methyl]-2-methylpyrrole-3-carboxamide

Names & synonyms

5-(2-Chloro-5-trifluoromethyl-phenyl)-1-((1RS,2RS)-2-hydroxy-cyclohexylmethyl)-2-methyl-1H-pyrrole-3-carboxylic acid cyclohexylamideSCHEMBL39274435-(2-Chloro-5-trifluoromethyl-phenyl)-1-((1SR,2RS)-2-hydroxy-cyclohexylmethyl)-2-methyl-1H-pyrrole-3-carboxylic acid cyclohexylamide

Database identifiers

PubChem CID
10074576

Properties

Computed structural properties

XLogP
6.3
Topological polar surface area
54.3 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
5
Heavy atoms
34

Related reactions

4 records

Compound notes

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