{5-[4-(2-Methoxy-ethyl)-2-(4-trifluoromethyl-phenyl)-pyrimidin-5-ylmethoxy]-indol-1-yl}-acetic acid ethyl ester

HCID 69641981
Substructure searchFind similar structures

Basic information

Standard SMILES
CCOC(=O)Cn1ccc2cc(OCc3cnc(-c4ccc(C(F)(F)F)cc4)nc3CCOC)ccc21
InChIKey
SBLAVBCNQGEVKF-UHFFFAOYSA-N
Molecular formula
C27H26F3N3O4
Average molar mass
513.5 g/mol

Names & identifiers

Preferred name
{5-[4-(2-Methoxy-ethyl)-2-(4-trifluoromethyl-phenyl)-pyrimidin-5-ylmethoxy]-indol-1-yl}-acetic acid ethyl ester
IUPAC
ethyl 2-[5-[[4-(2-methoxyethyl)-2-[4-(trifluoromethyl)phenyl]pyrimidin-5-yl]methoxy]indol-1-yl]acetate

Names & synonyms

{5-[4-(2-methoxy-ethyl)-2-(4-trifluoromethyl-phenyl)-pyrimidin-5-ylmethoxy]-indol-1-yl}-acetic acid ethyl esterSCHEMBL6029277

Database identifiers

PubChem CID
69641981

Properties

Computed structural properties

XLogP
4.8
Topological polar surface area
75.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
9
Rotatable bonds
11
Heavy atoms
37

Related reactions

4 records
New reaction record

Linked notes

Loading…