2-[(5-bromo-2-methoxyphenyl)sulfonylamino]-N-methylbenzamide

C15H15BrN2O4S — CID 26268702

IUPAC2-[(5-bromo-2-methoxyphenyl)sulfonylamino]-N-methylbenzamide
SMILESCNC(=O)c1ccccc1NS(=O)(=O)c1cc(Br)ccc1OC
InChIInChI=1S/C15H15BrN2O4S/c1-17-15(19)11-5-3-4-6-12(11)18-23(20,21)14-9-10(16)7-8-13(14)22-2/h3-9,18H,1-2H3,(H,17,19)
InChIKeyRDCXDEKVAPGWEM-UHFFFAOYSA-N
MW399.27 g/mol
LogP2.62
Rot. Bonds5

About 2-[(5-bromo-2-methoxyphenyl)sulfonylamino]-N-methylbenzamide

2-[(5-bromo-2-methoxyphenyl)sulfonylamino]-N-methylbenzamide (PubChem CID 26268702) has the molecular formula C15H15BrN2O4S and a molecular weight of 399.27 g/mol. Its IUPAC name is 2-[(5-bromo-2-methoxyphenyl)sulfonylamino]-N-methylbenzamide.

Molecular Properties

Compound Name2-[(5-bromo-2-methoxyphenyl)sulfonylamino]-N-methylbenzamide
PubChem CID26268702
Molecular FormulaC15H15BrN2O4S
Molecular Weight399.27 g/mol
Exact Mass397.99
IUPAC Name2-[(5-bromo-2-methoxyphenyl)sulfonylamino]-N-methylbenzamide
SMILESCNC(=O)c1ccccc1NS(=O)(=O)c1cc(Br)ccc1OC
InChIInChI=1S/C15H15BrN2O4S/c1-17-15(19)11-5-3-4-6-12(11)18-23(20,21)14-9-10(16)7-8-13(14)22-2/h3-9,18H,1-2H3,(H,17,19)
InChIKeyRDCXDEKVAPGWEM-UHFFFAOYSA-N
XLogP2.62
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.27
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-benzoylphenyl)-5-bromo-2-methoxybenzenesulfonamide
CID 100743808
2-[(5-bromo-2-methylphenyl)sulfonylamino]-N-methylbenzamide
CID 24502280
2-[(5-bromo-2-methoxyphenyl)sulfonylamino]-N-(1-phenylethyl)benzamide
CID 133228042
N-[2-(azepane-1-carbonyl)phenyl]-5-bromo-2-methoxybenzenesulfonamide
CID 100750695
N-(2-aminophenyl)-5-bromo-2-methoxybenzenesulfonamide
CID 43605604
2-[(5-bromo-2-methoxyphenyl)sulfonylamino]-5-methylbenzoic acid
CID 51114842
methyl 5-[(5-bromo-2-methoxyphenyl)sulfonylamino]-2,4-difluorobenzoate
CID 31808235
5-bromo-N-[2-(difluoromethoxy)phenyl]-2-methoxybenzenesulfonamide
CID 8504794
N-cyclopropyl-2-[(2,5-dimethoxyphenyl)sulfonylamino]benzamide
CID 7938855
N'-(5-bromo-2-methoxyphenyl)sulfonylbenzohydrazide
CID 26966791
2-[(2-aminophenyl)sulfonylamino]-N-methylbenzamide
CID 43576281
2-[(2-methoxyphenyl)sulfonylamino]benzoic acid
CID 43091453

Frequently Asked Questions

What is the IUPAC name of 2-[(5-bromo-2-methoxyphenyl)sulfonylamino]-N-methylbenzamide?
The IUPAC name of 2-[(5-bromo-2-methoxyphenyl)sulfonylamino]-N-methylbenzamide (CID 26268702) is 2-[(5-bromo-2-methoxyphenyl)sulfonylamino]-N-methylbenzamide.
What is the SMILES notation for 2-[(5-bromo-2-methoxyphenyl)sulfonylamino]-N-methylbenzamide?
The canonical SMILES for 2-[(5-bromo-2-methoxyphenyl)sulfonylamino]-N-methylbenzamide is CNC(=O)c1ccccc1NS(=O)(=O)c1cc(Br)ccc1OC.
What is the InChIKey of 2-[(5-bromo-2-methoxyphenyl)sulfonylamino]-N-methylbenzamide?
The InChIKey is RDCXDEKVAPGWEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15BrN2O4S/c1-17-15(19)11-5-3-4-6-12(11)18-23(20,21)14-9-10(16)7-8-13(14)22-2/h3-9,18H,1-2H3,(H,17,19).
What are the key properties of 2-[(5-bromo-2-methoxyphenyl)sulfonylamino]-N-methylbenzamide?
2-[(5-bromo-2-methoxyphenyl)sulfonylamino]-N-methylbenzamide has a molecular weight of 399.27 g/mol, XLogP of 2.62, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-bromo-2-methoxyphenyl)sulfonylamino]-N-methylbenzamide is sourced from PubChem (CID 26268702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).