4-Chlorothieno[3,2-D]pyrimidine

C₆H₃ClN₂SCAS 16269-66-2170.61 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₆H₃ClN₂S
Molar mass: 170.61 g/mol
Exact mass: 169.9705 Da
logP: 2.34Crippen estimate
Polar surface area: 25.8 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 0

Identifiers

CAS number

16269-66-2

SMILES

C1=CSC2=C1N=CN=C2Cl

InChIKey

TWTODSLDHCDLDR-UHFFFAOYSA-N

InChI

InChI=1S/C6H3ClN2S/c7-6-5-4(1-2-10-5)8-3-9-6/h1-3H

Weigh it out

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

Work with 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

2,4-Dichlorothieno[3,2-D]pyrimidine16234-14-353 % similar 4-Chloro-6-iodo-thieno[3,2-D]pyrimidine225382-62-747 % similar 6-Bromo-4-chlorothieno(3,2-d)pyrimidine225385-03-547 % similar 4-Chloro-7-methylthieno(3,2-d)pyrimidine175137-21-043 % similar 7-Bromo-4-chlorothieno[3,2-D]pyrimidine31169-27-443 % similar 6-Bromo-4-chloro-quinazoline38267-96-843 % similar 4,5,6-Trichloropyrimidine1780-27-441 % similar 3H,4H-Thieno[3,2-d]pyrimidin-4-one16234-10-940 % similar

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

Same formula

4-Chlorothieno[2,3-D]pyrimidine14080-59-2 5-Chlorobenzo-2,1,3-thiadiazole2207-32-1

Elsewhere

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