7-Bromo-4-chlorothieno[3,2-D]pyrimidine

C₆H₂BrClN₂SCAS 31169-27-4249.51 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₆H₂BrClN₂S
Molar mass: 249.51 g/mol
Exact mass: 247.8811 Da
logP: 3.11Crippen estimate
Polar surface area: 25.8 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 0

Identifiers

CAS number

31169-27-4

SMILES

C1=C(C2=C(S1)C(=NC=N2)Cl)Br

InChIKey

LJFZDPZIIKOATA-UHFFFAOYSA-N

InChI

InChI=1S/C6H2BrClN2S/c7-3-1-11-5-4(3)9-2-10-6(5)8/h1-2H

Weigh it out

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

Work with 7-Bromo-4-chlorothieno[3,2-D]pyrimidine

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-Chloro-7-methylthieno(3,2-d)pyrimidine175137-21-059 % similar 7-Bromo-4-chloro-5H-pyrrolo[3,2-D]pyrimidine1032650-41-146 % similar 7-Bromothieno(3,2-d)pyrimidin-4-ol31169-25-244 % similar 4-Chlorothieno[3,2-D]pyrimidine16269-66-243 % similar 5-Bromo-4,6-dichloropyrimidine68797-61-542 % similar 3,6-Dibromothieno(3,2-b)thiophene392662-65-641 % similar 5-Bromo-4-chloropyrimidine56181-39-641 % similar 5-Bromo-4-chloro-7H-pyrrolo[2,3-D]pyrimidine22276-95-538 % similar

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

Same formula

6-Bromo-4-chlorothieno(3,2-d)pyrimidine225385-03-5

Elsewhere

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