Methyl 2-(4'-(6-carbamoyl-3,5-dimethylpyrazin-2-yl)-2-fluorobiphenyl-4-yl)acetate

HCID 59627677

Completing data — usually done within a minute

Basic information

CAS
1259023-38-5
Standard SMILES
COC(=O)Cc1ccc(-c2ccc(-c3nc(C(N)=O)c(C)nc3C)cc2)c(F)c1
InChIKey
GOKLJKMQGQSHSX-UHFFFAOYSA-N
Molecular formula
C22H20FN3O3
Average molar mass
393.4 g/mol
Monoisotopic mass
393.14886972

Names & identifiers

Preferred name
Methyl 2-(4'-(6-carbamoyl-3,5-dimethylpyrazin-2-yl)-2-fluorobiphenyl-4-yl)acetate
IUPAC
methyl 2-[4-[4-(6-carbamoyl-3,5-dimethylpyrazin-2-yl)phenyl]-3-fluorophenyl]acetate

Names & synonyms

SCHEMBL2126270GOKLJKMQGQSHSX-UHFFFAOYSA-NDTXSID601112456methyl 2-(4'-(6-carbamoyl-3,5-dimethylpyrazin-2-yl)-2-fluorobiphenyl-4-yl)acetate1259023-38-5Methyl [4'-(6-carbamoyl-3,5-dimethylpyrazin-2-yl)-2-fluoro[1,1'-biphenyl]-4-yl]acetate[1,1a(2)-Biphenyl]-4-acetic acid, 4a(2)-[6-(aminocarbonyl)-3,5-dimethyl-2-pyrazinyl]-2-fluoro-, methyl ester

Database identifiers

CAS
1259023-38-5
PubChem CID
59627677
DTXSID
DTXSID601112456

Properties

Computed structural propertiesFilling in

XLogP
3
Topological polar surface area
95.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
6
Heavy atoms
29

Related reactions

4 records

Compound notes

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