5-Bromo-3-(4-(1,4-dimethyl-3-oxopiperazin-2-yl)phenylamino)-1-methylpyrazin-2(1H)-one

HCID 57625129

Basic information

Standard SMILES
CN1CCN(C)C(c2ccc(Nc3nc(Br)cn(C)c3=O)cc2)C1=O
InChIKey
ORRGNBHSDMOWDY-UHFFFAOYSA-N
Molecular formula
C17H20BrN5O2
Average molar mass
406.3 g/mol

Names & identifiers

Preferred name
5-Bromo-3-(4-(1,4-dimethyl-3-oxopiperazin-2-yl)phenylamino)-1-methylpyrazin-2(1H)-one
IUPAC
5-bromo-3-[4-(1,4-dimethyl-3-oxopiperazin-2-yl)anilino]-1-methylpyrazin-2-one

Names & synonyms

SCHEMBL1205490ORRGNBHSDMOWDY-UHFFFAOYSA-NDB-2130325-Bromo-3-(4-(1,4-dimethyl-3-oxopiperazin-2-yl)phenylamino)-1-methylpyrazin-2(1H)-one5-Bromo-3-[[4-(1,4-dimethyl-3-oxo-2-piperazinyl)phenyl]amino]-1-methyl-2(1h)-pyrazinone1133433-96-1

Database identifiers

PubChem CID
57625129

Properties

Computed structural properties

XLogP
1.1
Topological polar surface area
68.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
25

Related reactions

11 records

Compound notes

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