2-(4-bromo-2-chloro-6-sulfamoylphenoxy)acetamide

C8H8BrClN2O4S — CID 82920977

IUPAC2-(4-bromo-2-chloro-6-sulfamoylphenoxy)acetamide
SMILESNC(=O)COc1c(Cl)cc(Br)cc1S(N)(=O)=O
InChIInChI=1S/C8H8BrClN2O4S/c9-4-1-5(10)8(16-3-7(11)13)6(2-4)17(12,14)15/h1-2H,3H2,(H2,11,13)(H2,12,14,15)
InChIKeyILVAMKDGIBMYPC-UHFFFAOYSA-N
MW343.59 g/mol
LogP0.61
Rot. Bonds4

About 2-(4-bromo-2-chloro-6-sulfamoylphenoxy)acetamide

2-(4-bromo-2-chloro-6-sulfamoylphenoxy)acetamide (PubChem CID 82920977) has the molecular formula C8H8BrClN2O4S and a molecular weight of 343.59 g/mol. Its IUPAC name is 2-(4-bromo-2-chloro-6-sulfamoylphenoxy)acetamide.

Molecular Properties

Compound Name2-(4-bromo-2-chloro-6-sulfamoylphenoxy)acetamide
PubChem CID82920977
Molecular FormulaC8H8BrClN2O4S
Molecular Weight343.59 g/mol
Exact Mass341.91
IUPAC Name2-(4-bromo-2-chloro-6-sulfamoylphenoxy)acetamide
SMILESNC(=O)COc1c(Cl)cc(Br)cc1S(N)(=O)=O
InChIInChI=1S/C8H8BrClN2O4S/c9-4-1-5(10)8(16-3-7(11)13)6(2-4)17(12,14)15/h1-2H,3H2,(H2,11,13)(H2,12,14,15)
InChIKeyILVAMKDGIBMYPC-UHFFFAOYSA-N
XLogP0.61
TPSA112.48 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.59
LogP ≤ 50.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-bromo-2-(2-bromoprop-2-enoxy)-3-chlorobenzenesulfonamide
CID 82921777
2-(2,4-dibromo-6-chlorophenoxy)acetamide
CID 91674426
5-bromo-3-chloro-2-(2-fluoroethoxy)benzenesulfonamide
CID 80694291
5-bromo-3-chloro-2-(2,2,2-trifluoroethoxy)benzenesulfonamide
CID 43164412
5-bromo-3-chloro-2-pentoxybenzenesulfonamide
CID 43164418
5-bromo-3-chloro-2-(3,3-dimethylbutoxy)benzenesulfonamide
CID 61481199
5-bromo-3-chloro-2-(3-methylbutoxy)benzenesulfonamide
CID 43164414
2-(2-bromo-4,6-dichlorophenoxy)acetamide
CID 17096616
5-bromo-3-chloro-2-(2-propylsulfonylethoxy)benzenesulfonamide
CID 106726837
5-bromo-3-chloro-2-(2-morpholin-4-ylethoxy)benzenesulfonamide
CID 82913513
5-bromo-3-chloro-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzenesulfonamide
CID 82920902
2-(4-bromo-2-methyl-6-sulfamoylphenoxy)-N-propan-2-ylacetamide
CID 82915401

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromo-2-chloro-6-sulfamoylphenoxy)acetamide?
The IUPAC name of 2-(4-bromo-2-chloro-6-sulfamoylphenoxy)acetamide (CID 82920977) is 2-(4-bromo-2-chloro-6-sulfamoylphenoxy)acetamide.
What is the SMILES notation for 2-(4-bromo-2-chloro-6-sulfamoylphenoxy)acetamide?
The canonical SMILES for 2-(4-bromo-2-chloro-6-sulfamoylphenoxy)acetamide is NC(=O)COc1c(Cl)cc(Br)cc1S(N)(=O)=O.
What is the InChIKey of 2-(4-bromo-2-chloro-6-sulfamoylphenoxy)acetamide?
The InChIKey is ILVAMKDGIBMYPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8BrClN2O4S/c9-4-1-5(10)8(16-3-7(11)13)6(2-4)17(12,14)15/h1-2H,3H2,(H2,11,13)(H2,12,14,15).
What are the key properties of 2-(4-bromo-2-chloro-6-sulfamoylphenoxy)acetamide?
2-(4-bromo-2-chloro-6-sulfamoylphenoxy)acetamide has a molecular weight of 343.59 g/mol, XLogP of 0.61, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromo-2-chloro-6-sulfamoylphenoxy)acetamide is sourced from PubChem (CID 82920977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).