3,4-dichloro-N-(5-chloro-2-pyridinyl)benzenesulfonamide

C11H7Cl3N2O2S — CID 74229116

IUPAC3,4-dichloro-N-(5-chloro-2-pyridinyl)benzenesulfonamide
SMILESO=S(=O)(Nc1ccc(Cl)cn1)c1ccc(Cl)c(Cl)c1
InChIInChI=1S/C11H7Cl3N2O2S/c12-7-1-4-11(15-6-7)16-19(17,18)8-2-3-9(13)10(14)5-8/h1-6H,(H,15,16)
InChIKeyVRTZDLRHPQMUJS-UHFFFAOYSA-N
MW337.62 g/mol
LogP3.84
Rot. Bonds3

About 3,4-dichloro-N-(5-chloro-2-pyridinyl)benzenesulfonamide

3,4-dichloro-N-(5-chloro-2-pyridinyl)benzenesulfonamide (PubChem CID 74229116) has the molecular formula C11H7Cl3N2O2S and a molecular weight of 337.62 g/mol. Its IUPAC name is 3,4-dichloro-N-(5-chloro-2-pyridinyl)benzenesulfonamide.

Molecular Properties

Compound Name3,4-dichloro-N-(5-chloro-2-pyridinyl)benzenesulfonamide
PubChem CID74229116
Molecular FormulaC11H7Cl3N2O2S
Molecular Weight337.62 g/mol
Exact Mass335.93
IUPAC Name3,4-dichloro-N-(5-chloro-2-pyridinyl)benzenesulfonamide
SMILESO=S(=O)(Nc1ccc(Cl)cn1)c1ccc(Cl)c(Cl)c1
InChIInChI=1S/C11H7Cl3N2O2S/c12-7-1-4-11(15-6-7)16-19(17,18)8-2-3-9(13)10(14)5-8/h1-6H,(H,15,16)
InChIKeyVRTZDLRHPQMUJS-UHFFFAOYSA-N
XLogP3.84
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.62
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-chloro-2-pyridinyl)-3,4-difluorobenzenesulfonamide
CID 19683191
3-chloro-N-(5-chloro-2-pyridinyl)-4-cyanobenzenesulfonamide
CID 115619551
4-[(5-chloro-2-pyridinyl)sulfamoyl]benzoic acid
CID 6463370
6-[(3-chloro-4-fluorophenyl)sulfonylamino]pyridine-3-carboxylic acid
CID 61317579
4-[(5-chloro-2-pyridinyl)sulfamoyl]-2-methylbenzenecarbothioamide
CID 106919996
3,4-dichloro-N-(6-chloropyridazin-3-yl)benzenesulfonamide
CID 113235700
4-amino-2,6-dichloro-N-(5-chloro-2-pyridinyl)benzenesulfonamide
CID 43258680
4-[(5-chloro-2-pyridinyl)sulfamoyl]benzenecarbothioamide
CID 28893727
4-chloro-3-methyl-N-[5-(propan-2-ylamino)-2-pyridinyl]benzenesulfonamide
CID 113023662
4-chloro-N-(5-methyl-2-pyridinyl)benzenesulfonamide
CID 759580
5-[(5-chloro-2-pyridinyl)sulfamoyl]-2-methoxy-N-methylbenzamide
CID 6471703
5,6-dichloro-N-(5-fluoro-2-pyridinyl)pyridine-3-sulfonamide
CID 64687580

Frequently Asked Questions

What is the IUPAC name of 3,4-dichloro-N-(5-chloro-2-pyridinyl)benzenesulfonamide?
The IUPAC name of 3,4-dichloro-N-(5-chloro-2-pyridinyl)benzenesulfonamide (CID 74229116) is 3,4-dichloro-N-(5-chloro-2-pyridinyl)benzenesulfonamide.
What is the SMILES notation for 3,4-dichloro-N-(5-chloro-2-pyridinyl)benzenesulfonamide?
The canonical SMILES for 3,4-dichloro-N-(5-chloro-2-pyridinyl)benzenesulfonamide is O=S(=O)(Nc1ccc(Cl)cn1)c1ccc(Cl)c(Cl)c1.
What is the InChIKey of 3,4-dichloro-N-(5-chloro-2-pyridinyl)benzenesulfonamide?
The InChIKey is VRTZDLRHPQMUJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7Cl3N2O2S/c12-7-1-4-11(15-6-7)16-19(17,18)8-2-3-9(13)10(14)5-8/h1-6H,(H,15,16).
What are the key properties of 3,4-dichloro-N-(5-chloro-2-pyridinyl)benzenesulfonamide?
3,4-dichloro-N-(5-chloro-2-pyridinyl)benzenesulfonamide has a molecular weight of 337.62 g/mol, XLogP of 3.84, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dichloro-N-(5-chloro-2-pyridinyl)benzenesulfonamide is sourced from PubChem (CID 74229116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).