N-(2-(6-fluoro-1H-indol-3-yl)ethyl)-5-(3-fluorobenzyl)isoxazole-3-carboxamide

HCID 66831760
Substructure searchFind similar structures

Basic information

Standard SMILES
O=C(NCCc1c[nH]c2cc(F)ccc12)c1cc(Cc2cccc(F)c2)on1
InChIKey
UOZITCDJSMICGM-UHFFFAOYSA-N
Molecular formula
C21H17F2N3O2
Average molar mass
381.4 g/mol

Names & identifiers

Preferred name
N-(2-(6-fluoro-1H-indol-3-yl)ethyl)-5-(3-fluorobenzyl)isoxazole-3-carboxamide
IUPAC
N-[2-(6-fluoro-1H-indol-3-yl)ethyl]-5-[(3-fluorophenyl)methyl]-1,2-oxazole-3-carboxamide

Names & synonyms

SCHEMBL892089UOZITCDJSMICGM-UHFFFAOYSA-NN-(2-(6-fluoro-1H-indol-3-yl)ethyl)-5-(3-fluorobenzyl)isoxazole-3-carboxamide

Database identifiers

PubChem CID
66831760

Properties

Computed structural properties

XLogP
4.2
Topological polar surface area
70.9 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
28

Related reactions

3 records
New reaction record

Linked notes

Loading…