{4-methyl-6-[2-methyl-5-(4-trifluoromethoxy-phenyl)-2H-pyrazol-3-ylmethoxy]-indol-1-yl}-acetic acid tert-butyl ester

HCID 69280239
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
Cc1cc(OCc2cc(-c3ccc(OC(F)(F)F)cc3)nn2C)cc2c1ccn2CC(=O)OC(C)(C)C
InChIKey
OGDLWRWPDISUBI-UHFFFAOYSA-N
Molecular formula
C27H28F3N3O4
Average molar mass
515.5 g/mol

Names & identifiers

Preferred name
{4-methyl-6-[2-methyl-5-(4-trifluoromethoxy-phenyl)-2H-pyrazol-3-ylmethoxy]-indol-1-yl}-acetic acid tert-butyl ester
IUPAC
tert-butyl 2-[4-methyl-6-[[1-methyl-3-[4-(trifluoromethoxy)phenyl]pyrazol-5-yl]methoxy]indol-1-yl]acetate

Names & synonyms

{4-methyl-6-[2-methyl-5-(4-trifluoromethoxy-phenyl)-2H-pyrazol-3-ylmethoxy]-indol-1-yl}-acetic acid tert-butyl esterSCHEMBL5016818

Database identifiers

PubChem CID
69280239

Properties

Computed structural properties

XLogP
6
Topological polar surface area
67.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
8
Rotatable bonds
9
Heavy atoms
37

Related reactions

4 records
New reaction record

Compound notes

Loading…