2-(4'-(6-Carbamoyl-3,5-dimethylpyrazin-2-yl)-2,6-difluorobiphenyl-4-yl)acetic acid

HCID 59627656
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
Cc1nc(C)c(-c2ccc(-c3c(F)cc(CC(=O)O)cc3F)cc2)nc1C(N)=O
InChIKey
IFPDEMLKSFZQKG-UHFFFAOYSA-N
Molecular formula
C21H17F2N3O3
Average molar mass
397.4 g/mol

Names & identifiers

Preferred name
2-(4'-(6-Carbamoyl-3,5-dimethylpyrazin-2-yl)-2,6-difluorobiphenyl-4-yl)acetic acid
IUPAC
2-[4-[4-(6-carbamoyl-3,5-dimethylpyrazin-2-yl)phenyl]-3,5-difluorophenyl]acetic acid

Names & synonyms

SCHEMBL2126567IFPDEMLKSFZQKG-UHFFFAOYSA-N2-(4'-(6-carbamoyl-3,5-dimethylpyrazin-2-yl)-2,6-difluorobiphenyl-4-yl)acetic acid

Database identifiers

PubChem CID
59627656

Properties

Computed structural properties

XLogP
2.7
Topological polar surface area
106 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
7
Rotatable bonds
5
Heavy atoms
29

Related reactions

2 records
New reaction record

Compound notes

Loading…