2-chloro-6-(2,4-difluorophenyl)sulfanylpyridine

C11H6ClF2NS — CID 60726004

IUPAC2-chloro-6-(2,4-difluorophenyl)sulfanylpyridine
SMILESFc1ccc(Sc2cccc(Cl)n2)c(F)c1
InChIInChI=1S/C11H6ClF2NS/c12-10-2-1-3-11(15-10)16-9-5-4-7(13)6-8(9)14/h1-6H
InChIKeyACLHJZZFHPCLOT-UHFFFAOYSA-N
MW257.69 g/mol
LogP4.16
Rot. Bonds2

About 2-chloro-6-(2,4-difluorophenyl)sulfanylpyridine

2-chloro-6-(2,4-difluorophenyl)sulfanylpyridine (PubChem CID 60726004) has the molecular formula C11H6ClF2NS and a molecular weight of 257.69 g/mol. Its IUPAC name is 2-chloro-6-(2,4-difluorophenyl)sulfanylpyridine.

Molecular Properties

Compound Name2-chloro-6-(2,4-difluorophenyl)sulfanylpyridine
PubChem CID60726004
Molecular FormulaC11H6ClF2NS
Molecular Weight257.69 g/mol
Exact Mass256.99
IUPAC Name2-chloro-6-(2,4-difluorophenyl)sulfanylpyridine
SMILESFc1ccc(Sc2cccc(Cl)n2)c(F)c1
InChIInChI=1S/C11H6ClF2NS/c12-10-2-1-3-11(15-10)16-9-5-4-7(13)6-8(9)14/h1-6H
InChIKeyACLHJZZFHPCLOT-UHFFFAOYSA-N
XLogP4.16
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.69
LogP ≤ 54.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

6-(2,4-difluorophenyl)sulfanylpyridine-2-carboximidamide
CID 64593647
2,4-dichloro-6-(2,4-difluorophenyl)sulfanyl-1,3,5-triazine
CID 60726032
4-(2,4-difluorophenyl)sulfanyl-N-methylpyrimidin-2-amine
CID 80892854
2-chloro-6-methylsulfanylpyridine
CID 1477089
3-chloro-6-(2,5-difluorophenyl)sulfanylpyridazine
CID 43395599
3,6-dichloro-2-[(2,4-difluorophenyl)sulfanylmethyl]pyridine
CID 55127363
6-(2,4-difluorophenyl)sulfanylpyridazine-3-carboxylic acid
CID 60792591
5-chloro-2-(2,4-difluorophenyl)sulfanylaniline
CID 43345451
6-(2,4-difluorophenyl)sulfanyl-N,2-dimethylpyrimidin-4-amine
CID 80893816
4-chloro-6-(2,5-difluorophenyl)sulfanyl-2-methylpyrimidine
CID 55080102
(1R)-1-[2-(2,4-difluorophenyl)sulfanyl-6-fluorophenyl]ethanol
CID 63814899
2-chloro-6-(2-fluorophenyl)sulfanylpyrazine
CID 43260478

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-(2,4-difluorophenyl)sulfanylpyridine?
The IUPAC name of 2-chloro-6-(2,4-difluorophenyl)sulfanylpyridine (CID 60726004) is 2-chloro-6-(2,4-difluorophenyl)sulfanylpyridine.
What is the SMILES notation for 2-chloro-6-(2,4-difluorophenyl)sulfanylpyridine?
The canonical SMILES for 2-chloro-6-(2,4-difluorophenyl)sulfanylpyridine is Fc1ccc(Sc2cccc(Cl)n2)c(F)c1.
What is the InChIKey of 2-chloro-6-(2,4-difluorophenyl)sulfanylpyridine?
The InChIKey is ACLHJZZFHPCLOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6ClF2NS/c12-10-2-1-3-11(15-10)16-9-5-4-7(13)6-8(9)14/h1-6H.
What are the key properties of 2-chloro-6-(2,4-difluorophenyl)sulfanylpyridine?
2-chloro-6-(2,4-difluorophenyl)sulfanylpyridine has a molecular weight of 257.69 g/mol, XLogP of 4.16, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-(2,4-difluorophenyl)sulfanylpyridine is sourced from PubChem (CID 60726004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).