2-[4-(2-{[4-(4-Chlorophenyl)-1,3-thiazol-2-yl][4-(trifluoromethyl)benzyl]amino}ethyl)phenoxy]-2-methylpropanoic acid

HCID 59643166
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Basic information

Standard SMILES
CC(C)(Oc1ccc(CCN(Cc2ccc(C(F)(F)F)cc2)c2nc(-c3ccc(Cl)cc3)cs2)cc1)C(=O)O
InChIKey
XDSSOVKJBBOKAB-UHFFFAOYSA-N
Molecular formula
C29H26ClF3N2O3S
Average molar mass
575 g/mol
Monoisotopic mass
574.130476

Names & identifiers

Preferred name
2-[4-(2-{[4-(4-Chlorophenyl)-1,3-thiazol-2-yl][4-(trifluoromethyl)benzyl]amino}ethyl)phenoxy]-2-methylpropanoic acid
IUPAC
2-[4-[2-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-[[4-(trifluoromethyl)phenyl]methyl]amino]ethyl]phenoxy]-2-methylpropanoic acid

Names & synonyms

2-[4-(2-{[4-(4-Chlorophenyl)-1,3-thiazol-2-yl][4-(trifluoromethyl)benzyl]amino}ethyl)phenoxy]-2-methylpropanoic acidSCHEMBL4575381

Database identifiers

PubChem CID
59643166

Properties

Computed structural properties

XLogP
8.2
Topological polar surface area
90.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
9
Rotatable bonds
10
Heavy atoms
39

Related reactions

1 records
New reaction record

Linked notes

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