chempirical

2,4-Dichlorothieno[2,3-D]pyrimidine

C6H2Cl2N2SCAS 18740-39-1205.06 g/mol

Open in Covalent MOL file
ClNClSN
Aryl halide

Properties

Molecular formula
C6H2Cl2N2S
Molar mass
205.06 g/mol
Exact mass
203.9316 Da
logP
3.00Crippen estimate
Polar surface area
25.8 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
0

Identifiers

CAS number
18740-39-1
SMILES
Clc1nc(Cl)c2ccsc2n1
InChIKey
HRXNGIQKOWQHCX-UHFFFAOYSA-N
InChI
InChI=1S/C6H2Cl2N2S/c7-4-3-1-2-11-5(3)10-6(8)9-4/h1-2H

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Names and synonyms

1 names
  • Thieno[2,3-d]pyrimidine, 2,4-dichloro-

Work with 2,4-Dichlorothieno[2,3-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

2,4-Dichloroquinazoline607-68-145 % similar 7-Bromo-2,4-dichloroquinazoline959237-68-443 % similar 4-Chlorothieno[3,2-C]pyridine27685-94-542 % similar 2,4,7-Trichloropyrido[2,3-D]pyrimidine938443-20-042 % similar 2,4-Dichloro-pyrido[2,3-d]pyrimidine126728-20-941 % similar 2,4,6-Trichloroquinazoline20028-68-641 % similar 2,4,5,6-Tetrachloropyrimidine1780-40-141 % similar 2,4,6,8-Tetrachloropyrimido[5,4-D]pyrimidine32980-71-541 % similar

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

Elsewhere

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