N-(4-bromo-2,6-diethylphenyl)-2-[4-[(4-chlorophenyl)sulfamoyl]-2-methylphenoxy]acetamide

C25H26BrClN2O4S — CID 100796799

IUPACN-(4-bromo-2,6-diethylphenyl)-2-[4-[(4-chlorophenyl)sulfamoyl]-2-methylphenoxy]acetamide
SMILESCCc1cc(Br)cc(CC)c1NC(=O)COc1ccc(S(=O)(=O)Nc2ccc(Cl)cc2)cc1C
InChIInChI=1S/C25H26BrClN2O4S/c1-4-17-13-19(26)14-18(5-2)25(17)28-24(30)15-33-23-11-10-22(12-16(23)3)34(31,32)29-21-8-6-20(27)7-9-21/h6-14,29H,4-5,15H2,1-3H3,(H,28,30)
InChIKeyHRWAKSIWZXIWTQ-UHFFFAOYSA-N
MW565.92 g/mol
LogP6.35
Rot. Bonds9

About N-(4-bromo-2,6-diethylphenyl)-2-[4-[(4-chlorophenyl)sulfamoyl]-2-methylphenoxy]acetamide

N-(4-bromo-2,6-diethylphenyl)-2-[4-[(4-chlorophenyl)sulfamoyl]-2-methylphenoxy]acetamide (PubChem CID 100796799) has the molecular formula C25H26BrClN2O4S and a molecular weight of 565.92 g/mol. Its IUPAC name is N-(4-bromo-2,6-diethylphenyl)-2-[4-[(4-chlorophenyl)sulfamoyl]-2-methylphenoxy]acetamide.

Molecular Properties

Compound NameN-(4-bromo-2,6-diethylphenyl)-2-[4-[(4-chlorophenyl)sulfamoyl]-2-methylphenoxy]acetamide
PubChem CID100796799
Molecular FormulaC25H26BrClN2O4S
Molecular Weight565.92 g/mol
Exact Mass564.05
IUPAC NameN-(4-bromo-2,6-diethylphenyl)-2-[4-[(4-chlorophenyl)sulfamoyl]-2-methylphenoxy]acetamide
SMILESCCc1cc(Br)cc(CC)c1NC(=O)COc1ccc(S(=O)(=O)Nc2ccc(Cl)cc2)cc1C
InChIInChI=1S/C25H26BrClN2O4S/c1-4-17-13-19(26)14-18(5-2)25(17)28-24(30)15-33-23-11-10-22(12-16(23)3)34(31,32)29-21-8-6-20(27)7-9-21/h6-14,29H,4-5,15H2,1-3H3,(H,28,30)
InChIKeyHRWAKSIWZXIWTQ-UHFFFAOYSA-N
XLogP6.35
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms34
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500565.92
LogP ≤ 56.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(4-bromo-2,6-diethylphenyl)-2-[4-[(4-chlorophenyl)sulfamoyl]-2-methylphenoxy]acetamide 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-(4-bromo-2,6-diethylphenyl)-2-[2-chloro-4-[(4-chlorophenyl)sulfamoyl]phenoxy]acetamide
CID 100800120
N-(4-bromo-2,6-diethylphenyl)-2-[4-[(4-methoxyphenyl)sulfamoyl]-2-methylphenoxy]acetamide
CID 100796609
N-(4-bromo-2,6-diethylphenyl)-2-[2-methyl-4-(propylsulfamoyl)phenoxy]acetamide
CID 100796629
N-(4-bromo-2,6-diethylphenyl)-2-[4-[(3,4-dimethylphenyl)sulfamoyl]phenoxy]acetamide
CID 100800892
2-[4-[(4-chlorophenyl)sulfamoyl]-2-methylphenoxy]-N-[4-fluoro-3-(trifluoromethyl)phenyl]acetamide
CID 28555605
2-(4-chloro-2-methylphenoxy)-N-[4-[(3,5-dimethylphenyl)sulfamoyl]phenyl]acetamide
CID 1013139
2-[4-[(4-chlorophenyl)sulfamoyl]phenoxy]-N-(2,6-diethylphenyl)acetamide
CID 4024458
N-(4-bromo-2,6-dimethylphenyl)-2-[2-methyl-4-(propylsulfamoyl)phenoxy]acetamide
CID 100796625
2-[4-[(4-chlorophenyl)sulfamoyl]-2-methylphenoxy]-N-[(1S)-1-(3,4-dimethoxyphenyl)ethyl]acetamide
CID 28555570
N-(4-bromo-2,6-dimethylphenyl)-2-[4-(cyclohexylsulfamoyl)-2-methylphenoxy]acetamide
CID 100796699
N-(2-ethoxyphenyl)-2-[2-methyl-4-[(4-methylphenyl)sulfamoyl]phenoxy]acetamide
CID 2712532
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[2-methyl-4-[(4-methylphenyl)sulfamoyl]phenoxy]acetamide
CID 126388488

Frequently Asked Questions

What is the IUPAC name of N-(4-bromo-2,6-diethylphenyl)-2-[4-[(4-chlorophenyl)sulfamoyl]-2-methylphenoxy]acetamide?
The IUPAC name of N-(4-bromo-2,6-diethylphenyl)-2-[4-[(4-chlorophenyl)sulfamoyl]-2-methylphenoxy]acetamide (CID 100796799) is N-(4-bromo-2,6-diethylphenyl)-2-[4-[(4-chlorophenyl)sulfamoyl]-2-methylphenoxy]acetamide.
What is the SMILES notation for N-(4-bromo-2,6-diethylphenyl)-2-[4-[(4-chlorophenyl)sulfamoyl]-2-methylphenoxy]acetamide?
The canonical SMILES for N-(4-bromo-2,6-diethylphenyl)-2-[4-[(4-chlorophenyl)sulfamoyl]-2-methylphenoxy]acetamide is CCc1cc(Br)cc(CC)c1NC(=O)COc1ccc(S(=O)(=O)Nc2ccc(Cl)cc2)cc1C.
What is the InChIKey of N-(4-bromo-2,6-diethylphenyl)-2-[4-[(4-chlorophenyl)sulfamoyl]-2-methylphenoxy]acetamide?
The InChIKey is HRWAKSIWZXIWTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26BrClN2O4S/c1-4-17-13-19(26)14-18(5-2)25(17)28-24(30)15-33-23-11-10-22(12-16(23)3)34(31,32)29-21-8-6-20(27)7-9-21/h6-14,29H,4-5,15H2,1-3H3,(H,28,30).
What are the key properties of N-(4-bromo-2,6-diethylphenyl)-2-[4-[(4-chlorophenyl)sulfamoyl]-2-methylphenoxy]acetamide?
N-(4-bromo-2,6-diethylphenyl)-2-[4-[(4-chlorophenyl)sulfamoyl]-2-methylphenoxy]acetamide has a molecular weight of 565.92 g/mol, XLogP of 6.35, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromo-2,6-diethylphenyl)-2-[4-[(4-chlorophenyl)sulfamoyl]-2-methylphenoxy]acetamide is sourced from PubChem (CID 100796799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).