4,7-Dibromo[1,2,5]thiadiazolo[3,4-c]pyridine

C₅HBr₂N₃SCAS 333432-27-2294.95 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₅HBr₂N₃S
Molar mass: 294.95 g/mol
Exact mass: 292.8258 Da
logP: 2.61Crippen estimate
Polar surface area: 38.7 Å²
H-bond donors / acceptors: 0 / 4
Rotatable bonds: 0

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

333432-27-2

SMILES

C1=C(C2=NSN=C2C(=N1)Br)Br

InChIKey

LEHZIBSAFRVAJP-UHFFFAOYSA-N

InChI

InChI=1S/C5HBr2N3S/c6-2-1-8-5(7)4-3(2)9-11-10-4/h1H

Weigh it out

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Names and synonyms

1 names

[1,2,5]Thiadiazolo[3,4-C]pyridine, 4,7-dibromo-

Work with 4,7-Dibromo[1,2,5]thiadiazolo[3,4-c]pyridine

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

4,7-Dibromo-2,1,3-benzothiadiazole15155-41-654 % similar 4-Bromo-2,1,3-benzothiadiazole22034-13-541 % similar 4,7-Dibromo-5-fluoro-2,1,3-benzothiadiazole1347736-74-640 % similar 7-Bromo-benzo[C][1,2,5]thiadiazole-4-carbaldehyde1071224-34-439 % similar 2,3,5-Tribromopyridine75806-85-839 % similar 2,3-Dibromo-5-chloropyridine137628-17-236 % similar 2,3-Dibromo-5-methylpyridine29232-39-136 % similar 2,3-Dibromo-5-fluoropyridine878207-82-036 % similar

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

Elsewhere

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