4-amino-2,6-dichloro-N-(5-chloro-2-pyridinyl)benzenesulfonamide

C11H8Cl3N3O2S — CID 43258680

IUPAC4-amino-2,6-dichloro-N-(5-chloro-2-pyridinyl)benzenesulfonamide
SMILESNc1cc(Cl)c(S(=O)(=O)Nc2ccc(Cl)cn2)c(Cl)c1
InChIInChI=1S/C11H8Cl3N3O2S/c12-6-1-2-10(16-5-6)17-20(18,19)11-8(13)3-7(15)4-9(11)14/h1-5H,15H2,(H,16,17)
InChIKeyWXHNXPTZIYMYCD-UHFFFAOYSA-N
MW352.63 g/mol
LogP3.42
Rot. Bonds3

About 4-amino-2,6-dichloro-N-(5-chloro-2-pyridinyl)benzenesulfonamide

4-amino-2,6-dichloro-N-(5-chloro-2-pyridinyl)benzenesulfonamide (PubChem CID 43258680) has the molecular formula C11H8Cl3N3O2S and a molecular weight of 352.63 g/mol. Its IUPAC name is 4-amino-2,6-dichloro-N-(5-chloro-2-pyridinyl)benzenesulfonamide.

Molecular Properties

Compound Name4-amino-2,6-dichloro-N-(5-chloro-2-pyridinyl)benzenesulfonamide
PubChem CID43258680
Molecular FormulaC11H8Cl3N3O2S
Molecular Weight352.63 g/mol
Exact Mass350.94
IUPAC Name4-amino-2,6-dichloro-N-(5-chloro-2-pyridinyl)benzenesulfonamide
SMILESNc1cc(Cl)c(S(=O)(=O)Nc2ccc(Cl)cn2)c(Cl)c1
InChIInChI=1S/C11H8Cl3N3O2S/c12-6-1-2-10(16-5-6)17-20(18,19)11-8(13)3-7(15)4-9(11)14/h1-5H,15H2,(H,16,17)
InChIKeyWXHNXPTZIYMYCD-UHFFFAOYSA-N
XLogP3.42
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.63
LogP ≤ 53.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-(5-amino-2-pyridinyl)-4-bromo-2,6-dichlorobenzenesulfonamide
CID 43327264
3,4-dichloro-N-(5-chloro-2-pyridinyl)benzenesulfonamide
CID 74229116
5-amino-N-(5-chloro-2-pyridinyl)-2-methylbenzenesulfonamide
CID 28893400
N-(5-chloro-2-pyridinyl)-3,4-difluorobenzenesulfonamide
CID 19683191
4-amino-N-(5-chloro-2-pyridinyl)-2-nitrobenzenesulfonamide
CID 62144754
4-amino-2,6-dichloro-N-(4-chloro-2-iodophenyl)benzenesulfonamide
CID 107624642
4-amino-N-(5-bromo-2-pyridinyl)-2-chlorobenzenesulfonamide
CID 43114331
4-amino-2,6-dichloro-N-(1H-pyrazol-5-yl)benzenesulfonamide
CID 61393048
3-chloro-N-(5-chloro-2-pyridinyl)-4-cyanobenzenesulfonamide
CID 115619551
4-amino-2,6-dichloro-N-(2-methyl-4-pyridinyl)benzenesulfonamide
CID 79234681
5-chloro-N-(5-chloro-2-pyridinyl)-2-methoxybenzenesulfonamide
CID 839351
N-(5-chloro-2-pyridinyl)-2,5-dimethylbenzenesulfonamide
CID 8523459

Frequently Asked Questions

What is the IUPAC name of 4-amino-2,6-dichloro-N-(5-chloro-2-pyridinyl)benzenesulfonamide?
The IUPAC name of 4-amino-2,6-dichloro-N-(5-chloro-2-pyridinyl)benzenesulfonamide (CID 43258680) is 4-amino-2,6-dichloro-N-(5-chloro-2-pyridinyl)benzenesulfonamide.
What is the SMILES notation for 4-amino-2,6-dichloro-N-(5-chloro-2-pyridinyl)benzenesulfonamide?
The canonical SMILES for 4-amino-2,6-dichloro-N-(5-chloro-2-pyridinyl)benzenesulfonamide is Nc1cc(Cl)c(S(=O)(=O)Nc2ccc(Cl)cn2)c(Cl)c1.
What is the InChIKey of 4-amino-2,6-dichloro-N-(5-chloro-2-pyridinyl)benzenesulfonamide?
The InChIKey is WXHNXPTZIYMYCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8Cl3N3O2S/c12-6-1-2-10(16-5-6)17-20(18,19)11-8(13)3-7(15)4-9(11)14/h1-5H,15H2,(H,16,17).
What are the key properties of 4-amino-2,6-dichloro-N-(5-chloro-2-pyridinyl)benzenesulfonamide?
4-amino-2,6-dichloro-N-(5-chloro-2-pyridinyl)benzenesulfonamide has a molecular weight of 352.63 g/mol, XLogP of 3.42, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-2,6-dichloro-N-(5-chloro-2-pyridinyl)benzenesulfonamide is sourced from PubChem (CID 43258680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).