4-(6-Carbamoyl-3,5-dimethylpyrazin-2-yl)phenylboronic acid

HCID 59627741
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Basic information

Standard SMILES
Cc1nc(C)c(-c2ccc(B(O)O)cc2)nc1C(N)=O
InChIKey
JWOJBSCPJCLMLP-UHFFFAOYSA-N
Molecular formula
C13H14BN3O3
Average molar mass
271.08 g/mol

Names & identifiers

Preferred name
4-(6-Carbamoyl-3,5-dimethylpyrazin-2-yl)phenylboronic acid
IUPAC
[4-(6-carbamoyl-3,5-dimethylpyrazin-2-yl)phenyl]boronic acid

Names & synonyms

SCHEMBL2126583JWOJBSCPJCLMLP-UHFFFAOYSA-N4-(6-carbamoyl-3,5-dimethylpyrazin-2-yl)phenylboronic acid

Database identifiers

PubChem CID
59627741

Properties

Computed structural properties

Topological polar surface area
109 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
5
Rotatable bonds
3
Heavy atoms
20

Related reactions

13 records
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Compound notes

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