5,7-Dichlorothiazolo(5,4-d)pyrimidine

C₅HCl₂N₃SCAS 13479-88-4206.04 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₅HCl₂N₃S
Molar mass: 206.04 g/mol
Exact mass: 204.9268 Da
logP: 2.39Crippen 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

13479-88-4

SMILES

C1=NC2=C(S1)N=C(N=C2Cl)Cl

InChIKey

XYBGDWLYHQAUQM-UHFFFAOYSA-N

InChI

InChI=1S/C5HCl2N3S/c6-3-2-4(11-1-8-2)10-5(7)9-3/h1H

Weigh it out

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Names and synonyms

1 names

5,7-Dichlorothiazolo[5,4-D]pyrimidine

Work with 5,7-Dichlorothiazolo(5,4-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

2,4,6,8-Tetrachloropyrimido[5,4-d]pyrimidine32980-71-552 % similar 2,4-Dichlorothieno[3,2-D]pyrimidine16234-14-344 % similar 2,4-Dichlorothieno[2,3-d]pyrimidine18740-39-144 % similar 2,4-Dichloropyrido[3,2-D]pyrimidine39551-54-742 % similar 2,4,5,6-Tetrachloropyrimidine1780-40-141 % similar 2,6-Dichloro-9-methyl-9H-purine2382-10-739 % similar 2,4-Dichloro-7-methylthieno(3,2-d)pyrimidine35265-83-939 % similar 2,4,6-Trichloro-5-pyrimidinecarboxaldehyde50270-27-439 % similar

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

Elsewhere

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