chempirical

3-Bromo-5-chloro-2-pyrazinamine

C4H3BrClN3CAS 76537-18-3208.44 g/mol

Open in Covalent MOL file
H2NNClNBr
Aryl halidePrimary amine

Properties

Molecular formula
C4H3BrClN3
Molar mass
208.44 g/mol
Exact mass
206.9199 Da
logP
1.47Crippen estimate
Polar surface area
51.8 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
0

Identifiers

CAS number
76537-18-3
SMILES
Nc1ncc(Cl)nc1Br
InChIKey
ACFBUXHJONGLLF-UHFFFAOYSA-N
InChI
InChI=1S/C4H3BrClN3/c5-3-4(7)8-1-2(6)9-3/h1H,(H2,7,8)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

6 names
  • 2-Pyrazinamine, 3-bromo-5-chloro-
  • Pyrazinamine, 3-bromo-5-chloro-
  • 2-Amino-3-bromo-5-chloropyrazine
  • 3-Bromo-5-chloro-2-aminopyrazine
  • (3-Bromo-5-chloropyrazin-2-yl)amine
  • 3-Bromo-5-chloropyrazin-2-amine

Work with 3-Bromo-5-chloro-2-pyrazinamine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

3-Amino-2-bromo-6-chloropyridine1050501-88-647 % similar 5-Bromo-3-chloropyridin-2-amine38185-55-641 % similar 5-Chloro-2-pyrazinamine33332-29-539 % similar 6-Bromo-2-chloroquinoxaline55687-02-038 % similar 6-Chloro-2-pyrazinamine33332-28-438 % similar 2-Chloroquinoxaline1448-87-936 % similar 2,6-Dichloropyrazine4774-14-536 % similar 2-Amino-3,5-dibromopyridine35486-42-135 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

5-Bromo-4-chloropyrimidin-2-amine1044767-99-8

Elsewhere

PubChem CAS Common Chemistry NIST WebBook