(3-{[6-(5-Methyl-3-phenyl-isoxazol-4-ylmethoxy)-pyridine-3-carbonyl]-amino}-piperidin-1-yl)-acetic acid ethyl ester

HCID 68445346

Basic information

Standard SMILES
CCOC(=O)CN1CCCC(NC(=O)c2ccc(OCc3c(-c4ccccc4)noc3C)nc2)C1
InChIKey
GBFDRMHEJAPDDP-UHFFFAOYSA-N
Molecular formula
C26H30N4O5
Average molar mass
478.5 g/mol

Names & identifiers

Preferred name
(3-{[6-(5-Methyl-3-phenyl-isoxazol-4-ylmethoxy)-pyridine-3-carbonyl]-amino}-piperidin-1-yl)-acetic acid ethyl ester
IUPAC
ethyl 2-[3-[[6-[(5-methyl-3-phenyl-1,2-oxazol-4-yl)methoxy]pyridine-3-carbonyl]amino]piperidin-1-yl]acetate

Names & synonyms

SCHEMBL2930857CHEMBL3676492GBFDRMHEJAPDDP-UHFFFAOYSA-NBDBM133357US8846719, 40(3-{[6-(5-Methyl-3-phenyl-isoxazol-4-ylmethoxy)-pyridine-3-carbonyl]-amino}-piperidin-1-yl)-acetic acid ethyl ester

Database identifiers

PubChem CID
68445346
ChEMBL
CHEMBL3676492

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
107 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
8
Rotatable bonds
10
Heavy atoms
35

Related reactions

17 records

Compound notes

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