(6-{3-[4-Methyl-2-(4-trifluoromethyl-phenyl)-thiazol-5-yl]-propoxy}-indol-1-yl)-acetic acid tert-butyl ester

HCID 69280520
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Basic information

Standard SMILES
Cc1nc(-c2ccc(C(F)(F)F)cc2)sc1CCCOc1ccc2ccn(CC(=O)OC(C)(C)C)c2c1
InChIKey
YLFBPNQBMVXANO-UHFFFAOYSA-N
Molecular formula
C28H29F3N2O3S
Average molar mass
530.6 g/mol
Monoisotopic mass
530.18509845

Names & identifiers

Preferred name
(6-{3-[4-Methyl-2-(4-trifluoromethyl-phenyl)-thiazol-5-yl]-propoxy}-indol-1-yl)-acetic acid tert-butyl ester
IUPAC
tert-butyl 2-[6-[3-[4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]propoxy]indol-1-yl]acetate

Names & synonyms

(6-{3-[4-methyl-2-(4-trifluoromethyl-phenyl)-thiazol-5-yl]-propoxy}-indol-1-yl)-acetic acid tert-butyl esterSCHEMBL5017515

Database identifiers

PubChem CID
69280520

Properties

Computed structural properties

XLogP
7.3
Topological polar surface area
81.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
8
Rotatable bonds
10
Heavy atoms
37

Related reactions

4 records
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Compound notes

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