4-Chloro-6-iodo-thieno[3,2-D]pyrimidine

C₆H₂ClIN₂SCAS 225382-62-7296.51 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₆H₂ClIN₂S
Molar mass: 296.51 g/mol
Exact mass: 295.8672 Da
logP: 2.95Crippen estimate
Polar surface area: 25.8 Å²
H-bond donors / acceptors: 0 / 3
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

225382-62-7

SMILES

C1=C(SC2=C1N=CN=C2Cl)I

InChIKey

HLXTYHBQAVCTSJ-UHFFFAOYSA-N

InChI

InChI=1S/C6H2ClIN2S/c7-6-5-3(9-2-10-6)1-4(8)11-5/h1-2H

Weigh it out

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

Names and synonyms

1 names

4-Chloro-6-iodothieno(3,2-d)pyrimidine

Work with 4-Chloro-6-iodo-thieno[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

6-Bromo-4-chlorothieno(3,2-d)pyrimidine225385-03-559 % similar 7-Chloro-2-iodothieno(3,2-b)pyridine602303-26-453 % similar 4-Chlorothieno[3,2-D]pyrimidine16269-66-247 % similar 4,6-Dichloro-5-iodopyrimidine1137576-38-542 % similar 4,5,6-Trichloropyrimidine1780-27-440 % similar 4-Chloro-quinazoline5190-68-140 % similar 4-Chloro-7-methylthieno(3,2-d)pyrimidine175137-21-038 % similar 6-Bromo-4-chloro-quinazoline38267-96-838 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook