N-[4-(acetylsulfamoyl)phenyl]-2-(3,4-dichlorophenyl)acetamide

C16H14Cl2N2O4S — CID 2471941

IUPACN-[4-(acetylsulfamoyl)phenyl]-2-(3,4-dichlorophenyl)acetamide
SMILESCC(=O)NS(=O)(=O)c1ccc(NC(=O)Cc2ccc(Cl)c(Cl)c2)cc1
InChIInChI=1S/C16H14Cl2N2O4S/c1-10(21)20-25(23,24)13-5-3-12(4-6-13)19-16(22)9-11-2-7-14(17)15(18)8-11/h2-8H,9H2,1H3,(H,19,22)(H,20,21)
InChIKeyVBMDWYAWEVOYNU-UHFFFAOYSA-N
MW401.27 g/mol
LogP3.00
Rot. Bonds5

About N-[4-(acetylsulfamoyl)phenyl]-2-(3,4-dichlorophenyl)acetamide

N-[4-(acetylsulfamoyl)phenyl]-2-(3,4-dichlorophenyl)acetamide (PubChem CID 2471941) has the molecular formula C16H14Cl2N2O4S and a molecular weight of 401.27 g/mol. Its IUPAC name is N-[4-(acetylsulfamoyl)phenyl]-2-(3,4-dichlorophenyl)acetamide.

Molecular Properties

Compound NameN-[4-(acetylsulfamoyl)phenyl]-2-(3,4-dichlorophenyl)acetamide
PubChem CID2471941
Molecular FormulaC16H14Cl2N2O4S
Molecular Weight401.27 g/mol
Exact Mass400.01
IUPAC NameN-[4-(acetylsulfamoyl)phenyl]-2-(3,4-dichlorophenyl)acetamide
SMILESCC(=O)NS(=O)(=O)c1ccc(NC(=O)Cc2ccc(Cl)c(Cl)c2)cc1
InChIInChI=1S/C16H14Cl2N2O4S/c1-10(21)20-25(23,24)13-5-3-12(4-6-13)19-16(22)9-11-2-7-14(17)15(18)8-11/h2-8H,9H2,1H3,(H,19,22)(H,20,21)
InChIKeyVBMDWYAWEVOYNU-UHFFFAOYSA-N
XLogP3.00
TPSA92.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500401.27
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(acetylsulfamoyl)phenyl]-2-(4-fluorophenyl)acetamide
CID 3379076
2-(3,4-dichlorophenyl)-N-[4-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]acetamide
CID 17403515
2-(3,4-dichlorophenyl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamide
CID 2425143
2-(3,4-dichlorophenyl)-N-(4-propan-2-ylphenyl)acetamide
CID 7957082
N,N'-bis[4-(acetylsulfamoyl)phenyl]hexanediamide
CID 3474503
N,N'-bis[4-(acetylsulfamoyl)phenyl]pentanediamide
CID 4199591
N-(4-bromophenyl)-2-(3,4-dichlorophenyl)acetamide
CID 2598783
N-[4-(2-bromoethyl)phenyl]-2-(3,4-dichlorophenyl)acetamide
CID 114310214
2-(3,4-dichlorophenyl)-N-(3,4-dimethylphenyl)acetamide
CID 8743954
2-(3,4-dichlorophenyl)-N-[4-methyl-3-(methylsulfamoyl)phenyl]acetamide
CID 9107151
2-(4-acetamidophenyl)-N-[4-[(4-methylphenyl)sulfonylamino]phenyl]acetamide
CID 55377318
2-(3,4-dichlorophenyl)-N-[4-(4-methylphenoxy)phenyl]acetamide
CID 7925219

Frequently Asked Questions

What is the IUPAC name of N-[4-(acetylsulfamoyl)phenyl]-2-(3,4-dichlorophenyl)acetamide?
The IUPAC name of N-[4-(acetylsulfamoyl)phenyl]-2-(3,4-dichlorophenyl)acetamide (CID 2471941) is N-[4-(acetylsulfamoyl)phenyl]-2-(3,4-dichlorophenyl)acetamide.
What is the SMILES notation for N-[4-(acetylsulfamoyl)phenyl]-2-(3,4-dichlorophenyl)acetamide?
The canonical SMILES for N-[4-(acetylsulfamoyl)phenyl]-2-(3,4-dichlorophenyl)acetamide is CC(=O)NS(=O)(=O)c1ccc(NC(=O)Cc2ccc(Cl)c(Cl)c2)cc1.
What is the InChIKey of N-[4-(acetylsulfamoyl)phenyl]-2-(3,4-dichlorophenyl)acetamide?
The InChIKey is VBMDWYAWEVOYNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14Cl2N2O4S/c1-10(21)20-25(23,24)13-5-3-12(4-6-13)19-16(22)9-11-2-7-14(17)15(18)8-11/h2-8H,9H2,1H3,(H,19,22)(H,20,21).
What are the key properties of N-[4-(acetylsulfamoyl)phenyl]-2-(3,4-dichlorophenyl)acetamide?
N-[4-(acetylsulfamoyl)phenyl]-2-(3,4-dichlorophenyl)acetamide has a molecular weight of 401.27 g/mol, XLogP of 3.00, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(acetylsulfamoyl)phenyl]-2-(3,4-dichlorophenyl)acetamide is sourced from PubChem (CID 2471941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).