2,3,5-trichloro-6-[(3-chloro-2-pyridinyl)sulfanyl]pyridine

C10H4Cl4N2S — CID 102752380

IUPAC2,3,5-trichloro-6-[(3-chloro-2-pyridinyl)sulfanyl]pyridine
SMILESClc1cc(Cl)c(Sc2ncccc2Cl)nc1Cl
InChIInChI=1S/C10H4Cl4N2S/c11-5-2-1-3-15-9(5)17-10-7(13)4-6(12)8(14)16-10/h1-4H
InChIKeyDLWMJOMNIUQRQE-UHFFFAOYSA-N
MW326.04 g/mol
LogP5.24
Rot. Bonds2

About 2,3,5-trichloro-6-[(3-chloro-2-pyridinyl)sulfanyl]pyridine

2,3,5-trichloro-6-[(3-chloro-2-pyridinyl)sulfanyl]pyridine (PubChem CID 102752380) has the molecular formula C10H4Cl4N2S and a molecular weight of 326.04 g/mol. Its IUPAC name is 2,3,5-trichloro-6-[(3-chloro-2-pyridinyl)sulfanyl]pyridine.

Molecular Properties

Compound Name2,3,5-trichloro-6-[(3-chloro-2-pyridinyl)sulfanyl]pyridine
PubChem CID102752380
Molecular FormulaC10H4Cl4N2S
Molecular Weight326.04 g/mol
Exact Mass323.88
IUPAC Name2,3,5-trichloro-6-[(3-chloro-2-pyridinyl)sulfanyl]pyridine
SMILESClc1cc(Cl)c(Sc2ncccc2Cl)nc1Cl
InChIInChI=1S/C10H4Cl4N2S/c11-5-2-1-3-15-9(5)17-10-7(13)4-6(12)8(14)16-10/h1-4H
InChIKeyDLWMJOMNIUQRQE-UHFFFAOYSA-N
XLogP5.24
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500326.04
LogP ≤ 55.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[(3-bromo-2-pyridinyl)sulfanyl]-3,5,6-trichloropyridine
CID 102752375
2,3,5-trichloro-6-thiophen-2-ylsulfanylpyridine
CID 102752219
2,3,5-trichloro-6-(2-fluorophenyl)sulfanylpyridine
CID 102752241
2-chloro-4-[(3-chloro-2-pyridinyl)sulfanyl]-5-fluoropyrimidine
CID 79075598
2,3,5-trichloro-6-(1H-imidazol-2-ylsulfanyl)pyridine
CID 107780767
2-[(3-chloro-2-pyridinyl)sulfanyl]-4-methylpyridine
CID 819435
3-[(3-chloro-2-pyridinyl)sulfanyl]phenol
CID 104590879
2-[(3-chloro-2-pyridinyl)sulfanyl]-4-methylpyrimidine
CID 91252009
2-bromo-5-[(3-chloro-2-pyridinyl)sulfanyl]-1,3,4-thiadiazole
CID 64623723
4-[(3-chloro-2-pyridinyl)sulfanyl]aniline
CID 61370219
(1R)-1-[3-chloro-4-[(3-chloro-2-pyridinyl)sulfanyl]phenyl]ethanamine
CID 78992849
5-bromo-4-[(3-chloro-2-pyridinyl)sulfanyl]pyrimidine
CID 66320532

Frequently Asked Questions

What is the IUPAC name of 2,3,5-trichloro-6-[(3-chloro-2-pyridinyl)sulfanyl]pyridine?
The IUPAC name of 2,3,5-trichloro-6-[(3-chloro-2-pyridinyl)sulfanyl]pyridine (CID 102752380) is 2,3,5-trichloro-6-[(3-chloro-2-pyridinyl)sulfanyl]pyridine.
What is the SMILES notation for 2,3,5-trichloro-6-[(3-chloro-2-pyridinyl)sulfanyl]pyridine?
The canonical SMILES for 2,3,5-trichloro-6-[(3-chloro-2-pyridinyl)sulfanyl]pyridine is Clc1cc(Cl)c(Sc2ncccc2Cl)nc1Cl.
What is the InChIKey of 2,3,5-trichloro-6-[(3-chloro-2-pyridinyl)sulfanyl]pyridine?
The InChIKey is DLWMJOMNIUQRQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H4Cl4N2S/c11-5-2-1-3-15-9(5)17-10-7(13)4-6(12)8(14)16-10/h1-4H.
What are the key properties of 2,3,5-trichloro-6-[(3-chloro-2-pyridinyl)sulfanyl]pyridine?
2,3,5-trichloro-6-[(3-chloro-2-pyridinyl)sulfanyl]pyridine has a molecular weight of 326.04 g/mol, XLogP of 5.24, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,5-trichloro-6-[(3-chloro-2-pyridinyl)sulfanyl]pyridine is sourced from PubChem (CID 102752380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).