N-(3-bromophenyl)-4-methoxy-3-(methylsulfamoyl)benzamide

C15H15BrN2O4S — CID 40742194

IUPACN-(3-bromophenyl)-4-methoxy-3-(methylsulfamoyl)benzamide
SMILESCNS(=O)(=O)c1cc(C(=O)Nc2cccc(Br)c2)ccc1OC
InChIInChI=1S/C15H15BrN2O4S/c1-17-23(20,21)14-8-10(6-7-13(14)22-2)15(19)18-12-5-3-4-11(16)9-12/h3-9,17H,1-2H3,(H,18,19)
InChIKeyYWXBWYUJQRWGKA-UHFFFAOYSA-N
MW399.27 g/mol
LogP2.62
Rot. Bonds5

About N-(3-bromophenyl)-4-methoxy-3-(methylsulfamoyl)benzamide

N-(3-bromophenyl)-4-methoxy-3-(methylsulfamoyl)benzamide (PubChem CID 40742194) has the molecular formula C15H15BrN2O4S and a molecular weight of 399.27 g/mol. Its IUPAC name is N-(3-bromophenyl)-4-methoxy-3-(methylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-(3-bromophenyl)-4-methoxy-3-(methylsulfamoyl)benzamide
PubChem CID40742194
Molecular FormulaC15H15BrN2O4S
Molecular Weight399.27 g/mol
Exact Mass397.99
IUPAC NameN-(3-bromophenyl)-4-methoxy-3-(methylsulfamoyl)benzamide
SMILESCNS(=O)(=O)c1cc(C(=O)Nc2cccc(Br)c2)ccc1OC
InChIInChI=1S/C15H15BrN2O4S/c1-17-23(20,21)14-8-10(6-7-13(14)22-2)15(19)18-12-5-3-4-11(16)9-12/h3-9,17H,1-2H3,(H,18,19)
InChIKeyYWXBWYUJQRWGKA-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

Analyze N-(3-bromophenyl)-4-methoxy-3-(methylsulfamoyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(3-bromophenyl)-4-methoxy-3-methylsulfonylbenzamide
CID 110425977
N-(3-bromophenyl)-3-(cyclopentylsulfamoyl)-4-methoxybenzamide
CID 29435478
N-(3-ethynylphenyl)-4-methoxy-3-(methylsulfamoyl)benzamide
CID 18147880
4-methoxy-3-(methylsulfamoyl)-N-(3-nitrophenyl)benzamide
CID 40742222
4-methoxy-3-(methylsulfamoyl)-N-pyridin-4-ylbenzamide
CID 27700507
N-(3-bromophenyl)-4-(methylsulfamoyl)benzamide
CID 17459459
N-[2-(3-bromophenoxy)ethyl]-4-methoxy-3-(methylsulfamoyl)benzamide
CID 55975758
N-(3-chloro-4-methylphenyl)-4-methoxy-3-(methylsulfamoyl)benzamide
CID 40742199
4-methoxy-3-(methylsulfamoyl)-N-[3-(pyridin-2-ylmethylcarbamoyl)phenyl]benzamide
CID 55964388
3-(tert-butylsulfamoyl)-N-(3-chlorophenyl)-4-methoxybenzamide
CID 26578598
4-methoxy-3-(methylsulfamoyl)-N-[4-(trifluoromethyl)phenyl]benzamide
CID 40742205
3-[(4-bromophenyl)sulfamoyl]-N-(3-ethynylphenyl)-4-methoxybenzamide
CID 30285125

Frequently Asked Questions

What is the IUPAC name of N-(3-bromophenyl)-4-methoxy-3-(methylsulfamoyl)benzamide?
The IUPAC name of N-(3-bromophenyl)-4-methoxy-3-(methylsulfamoyl)benzamide (CID 40742194) is N-(3-bromophenyl)-4-methoxy-3-(methylsulfamoyl)benzamide.
What is the SMILES notation for N-(3-bromophenyl)-4-methoxy-3-(methylsulfamoyl)benzamide?
The canonical SMILES for N-(3-bromophenyl)-4-methoxy-3-(methylsulfamoyl)benzamide is CNS(=O)(=O)c1cc(C(=O)Nc2cccc(Br)c2)ccc1OC.
What is the InChIKey of N-(3-bromophenyl)-4-methoxy-3-(methylsulfamoyl)benzamide?
The InChIKey is YWXBWYUJQRWGKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15BrN2O4S/c1-17-23(20,21)14-8-10(6-7-13(14)22-2)15(19)18-12-5-3-4-11(16)9-12/h3-9,17H,1-2H3,(H,18,19).
What are the key properties of N-(3-bromophenyl)-4-methoxy-3-(methylsulfamoyl)benzamide?
N-(3-bromophenyl)-4-methoxy-3-(methylsulfamoyl)benzamide 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 N-(3-bromophenyl)-4-methoxy-3-(methylsulfamoyl)benzamide is sourced from PubChem (CID 40742194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).