chempirical

7-Chlorothieno[3,2-B]pyridine

C7H4ClNSCAS 69627-03-8169.63 g/mol

Open in Covalent MOL file
NSCl
Aryl halide

Properties

Molecular formula
C7H4ClNS
Molar mass
169.63 g/mol
Exact mass
168.9753 Da
logP
2.95Crippen estimate
Polar surface area
12.9 Ų
H-bond donors / acceptors
0 / 2
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
69627-03-8
SMILES
C1=CN=C2C=CSC2=C1Cl
InChIKey
GYQUXKQLCNFKQT-UHFFFAOYSA-N
InChI
InChI=1S/C7H4ClNS/c8-5-1-3-9-6-2-4-10-7(5)6/h1-4H

Weigh it out

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

Work with 7-Chlorothieno[3,2-B]pyridine

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-Chlorothieno[3,2-D]pyrimidine16269-66-252 % similar 7-Chloro-2-iodothieno(3,2-b)pyridine602303-26-449 % similar 4-Chloroquinoline611-35-848 % similar 4,5-Dichloroquinoline21617-18-545 % similar 4,6-Dichloroquinoline4203-18-344 % similar 2,4-Dichlorothieno[3,2-D]pyrimidine16234-14-342 % similar 4-Chloro-6-methylquinoline18436-71-042 % similar 4-Chloro-6-fluoroquinoline391-77-542 % similar

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

Same formula

4-Chlorophenyl isothiocyanate2131-55-7 3-Chlorophenyl isothiocyanate2392-68-9 2-Chlorophenyl isothiocyanate2740-81-0 4-Chlorothieno[3,2-c]pyridine27685-94-5 2-Chlorobenzothiazole615-20-3 3-Chloro-1,2-benzisothiazole7716-66-7

Elsewhere

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