chempirical

5-Bromo-4-chloro-2,3-pyridinediamine

C5H5BrClN3CAS 1131604-99-3222.47 g/mol

Open in Covalent MOL file
HNHNBrClH2N
Aryl halidePrimary amine

Properties

Molecular formula
C5H5BrClN3
Molar mass
222.47 g/mol
Exact mass
220.9355 Da
Melting point
164 °C
logP
1.49Crippen estimate
Polar surface area
65.7 Ų
H-bond donors / acceptors
3 / 2
Rotatable bonds
0

Identifiers

CAS number
1131604-99-3
SMILES
N=c1[nH]cc(Br)c(Cl)c1N
InChIKey
IWPLIMBNUFTLIL-UHFFFAOYSA-N
InChI
InChI=1S/C5H5BrClN3/c6-2-1-10-5(9)4(8)3(2)7/h1H,8H2,(H2,9,10)

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Names and synonyms

1 names
  • 2,3-Pyridinediamine, 5-bromo-4-chloro-

Work with 5-Bromo-4-chloro-2,3-pyridinediamine

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

5-Bromo-4-chloro-3-nitro-2-pyridinamine942947-95-750 % similar 5-Bromo-3,4-dimethyl-2-pyridinamine374537-97-043 % similar 4,6-Dibromo-2,3-dichloroaniline113571-15-641 % similar 6-Chloro-4,5-pyrimidinediamine4316-98-741 % similar 5-Bromo-4-chloro-1H-pyrrolo[2,3-B]pyridine876343-82-738 % similar 2,6-Dibromoaniline608-30-035 % similar 2,6-Dibromo-4-chloroaniline874-17-935 % similar 4,5,6-Pyrimidinetriamine118-70-735 % similar

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

Elsewhere

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