4-(6-Bromo-4-methyl-3-oxo-3,4-dihydro-pyrazin-2-ylamino)-benzoic acid ethyl ester

HCID 58728992
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
CCOC(=O)c1ccc(Nc2nc(Br)cn(C)c2=O)cc1
InChIKey
JNWGPVPVSLNRMG-UHFFFAOYSA-N
Molecular formula
C14H14BrN3O3
Average molar mass
352.18 g/mol

Names & identifiers

Preferred name
4-(6-Bromo-4-methyl-3-oxo-3,4-dihydro-pyrazin-2-ylamino)-benzoic acid ethyl ester
IUPAC
ethyl 4-[(6-bromo-4-methyl-3-oxopyrazin-2-yl)amino]benzoate

Names & synonyms

SCHEMBL1067111JNWGPVPVSLNRMG-UHFFFAOYSA-N4-(6-Bromo-4-methyl-3-oxo-3,4-dihydro-pyrazin-2-ylamino)-benzoic acid ethyl ester

Database identifiers

PubChem CID
58728992

Properties

Computed structural properties

XLogP
2
Topological polar surface area
71 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
21

Related reactions

7 records
New reaction record

Compound notes

Loading…