6-amino-N-(2-bromo-5-chlorophenyl)-5-chloropyridine-3-sulfonamide

C11H8BrCl2N3O2S — CID 81275515

IUPAC6-amino-N-(2-bromo-5-chlorophenyl)-5-chloropyridine-3-sulfonamide
SMILESNc1ncc(S(=O)(=O)Nc2cc(Cl)ccc2Br)cc1Cl
InChIInChI=1S/C11H8BrCl2N3O2S/c12-8-2-1-6(13)3-10(8)17-20(18,19)7-4-9(14)11(15)16-5-7/h1-5,17H,(H2,15,16)
InChIKeyDMXHZCPUFAPJFK-UHFFFAOYSA-N
MW397.08 g/mol
LogP3.53
Rot. Bonds3

About 6-amino-N-(2-bromo-5-chlorophenyl)-5-chloropyridine-3-sulfonamide

6-amino-N-(2-bromo-5-chlorophenyl)-5-chloropyridine-3-sulfonamide (PubChem CID 81275515) has the molecular formula C11H8BrCl2N3O2S and a molecular weight of 397.08 g/mol. Its IUPAC name is 6-amino-N-(2-bromo-5-chlorophenyl)-5-chloropyridine-3-sulfonamide.

Molecular Properties

Compound Name6-amino-N-(2-bromo-5-chlorophenyl)-5-chloropyridine-3-sulfonamide
PubChem CID81275515
Molecular FormulaC11H8BrCl2N3O2S
Molecular Weight397.08 g/mol
Exact Mass394.89
IUPAC Name6-amino-N-(2-bromo-5-chlorophenyl)-5-chloropyridine-3-sulfonamide
SMILESNc1ncc(S(=O)(=O)Nc2cc(Cl)ccc2Br)cc1Cl
InChIInChI=1S/C11H8BrCl2N3O2S/c12-8-2-1-6(13)3-10(8)17-20(18,19)7-4-9(14)11(15)16-5-7/h1-5,17H,(H2,15,16)
InChIKeyDMXHZCPUFAPJFK-UHFFFAOYSA-N
XLogP3.53
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.08
LogP ≤ 53.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-amino-N-(2-bromo-5-methylphenyl)-5-chloropyridine-3-sulfonamide
CID 82767078
6-amino-N-(5-bromo-2-methylphenyl)-5-chloropyridine-3-sulfonamide
CID 64602240
4-amino-N-(2-bromo-5-chlorophenyl)benzenesulfonamide
CID 81263027
6-amino-5-chloro-N-(2,3-difluorophenyl)pyridine-3-sulfonamide
CID 64600885
6-amino-N-(5-bromo-2-cyanophenyl)-5-chloropyridine-3-sulfonamide
CID 107801188
6-amino-5-chloro-N-(2-methylphenyl)pyridine-3-sulfonamide
CID 64608701
3-amino-N-(2-bromo-5-chlorophenyl)-4-fluorobenzenesulfonamide
CID 81262729
6-amino-5-chloro-N-(3-chloro-2-methylphenyl)pyridine-3-sulfonamide
CID 64606596
N-(2-bromo-5-chlorophenyl)-1H-pyrazole-4-sulfonamide
CID 81274575
6-amino-5-chloro-N-(4-methyl-3-pyridinyl)pyridine-3-sulfonamide
CID 64601518
3-amino-N-(2-bromo-5-chlorophenyl)-5-fluorobenzenesulfonamide
CID 81262265
5-chloro-N-(5-chloro-2-fluorophenyl)-6-hydrazinylpyridine-3-sulfonamide
CID 64608935

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-(2-bromo-5-chlorophenyl)-5-chloropyridine-3-sulfonamide?
The IUPAC name of 6-amino-N-(2-bromo-5-chlorophenyl)-5-chloropyridine-3-sulfonamide (CID 81275515) is 6-amino-N-(2-bromo-5-chlorophenyl)-5-chloropyridine-3-sulfonamide.
What is the SMILES notation for 6-amino-N-(2-bromo-5-chlorophenyl)-5-chloropyridine-3-sulfonamide?
The canonical SMILES for 6-amino-N-(2-bromo-5-chlorophenyl)-5-chloropyridine-3-sulfonamide is Nc1ncc(S(=O)(=O)Nc2cc(Cl)ccc2Br)cc1Cl.
What is the InChIKey of 6-amino-N-(2-bromo-5-chlorophenyl)-5-chloropyridine-3-sulfonamide?
The InChIKey is DMXHZCPUFAPJFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8BrCl2N3O2S/c12-8-2-1-6(13)3-10(8)17-20(18,19)7-4-9(14)11(15)16-5-7/h1-5,17H,(H2,15,16).
What are the key properties of 6-amino-N-(2-bromo-5-chlorophenyl)-5-chloropyridine-3-sulfonamide?
6-amino-N-(2-bromo-5-chlorophenyl)-5-chloropyridine-3-sulfonamide has a molecular weight of 397.08 g/mol, XLogP of 3.53, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-(2-bromo-5-chlorophenyl)-5-chloropyridine-3-sulfonamide is sourced from PubChem (CID 81275515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).