5-chloro-2-(2-chlorophenyl)sulfanylpyridine

C11H7Cl2NS — CID 66218398

IUPAC5-chloro-2-(2-chlorophenyl)sulfanylpyridine
SMILESClc1ccc(Sc2ccccc2Cl)nc1
InChIInChI=1S/C11H7Cl2NS/c12-8-5-6-11(14-7-8)15-10-4-2-1-3-9(10)13/h1-7H
InChIKeyKVFYZYSFTGDPQI-UHFFFAOYSA-N
MW256.16 g/mol
LogP4.54
Rot. Bonds2

About 5-chloro-2-(2-chlorophenyl)sulfanylpyridine

5-chloro-2-(2-chlorophenyl)sulfanylpyridine (PubChem CID 66218398) has the molecular formula C11H7Cl2NS and a molecular weight of 256.16 g/mol. Its IUPAC name is 5-chloro-2-(2-chlorophenyl)sulfanylpyridine.

Molecular Properties

Compound Name5-chloro-2-(2-chlorophenyl)sulfanylpyridine
PubChem CID66218398
Molecular FormulaC11H7Cl2NS
Molecular Weight256.16 g/mol
Exact Mass254.97
IUPAC Name5-chloro-2-(2-chlorophenyl)sulfanylpyridine
SMILESClc1ccc(Sc2ccccc2Cl)nc1
InChIInChI=1S/C11H7Cl2NS/c12-8-5-6-11(14-7-8)15-10-4-2-1-3-9(10)13/h1-7H
InChIKeyKVFYZYSFTGDPQI-UHFFFAOYSA-N
XLogP4.54
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.16
LogP ≤ 54.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-(2-chlorophenyl)sulfanylpyridine?
The IUPAC name of 5-chloro-2-(2-chlorophenyl)sulfanylpyridine (CID 66218398) is 5-chloro-2-(2-chlorophenyl)sulfanylpyridine.
What is the SMILES notation for 5-chloro-2-(2-chlorophenyl)sulfanylpyridine?
The canonical SMILES for 5-chloro-2-(2-chlorophenyl)sulfanylpyridine is Clc1ccc(Sc2ccccc2Cl)nc1.
What is the InChIKey of 5-chloro-2-(2-chlorophenyl)sulfanylpyridine?
The InChIKey is KVFYZYSFTGDPQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7Cl2NS/c12-8-5-6-11(14-7-8)15-10-4-2-1-3-9(10)13/h1-7H.
What are the key properties of 5-chloro-2-(2-chlorophenyl)sulfanylpyridine?
5-chloro-2-(2-chlorophenyl)sulfanylpyridine has a molecular weight of 256.16 g/mol, XLogP of 4.54, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-(2-chlorophenyl)sulfanylpyridine is sourced from PubChem (CID 66218398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).