2-(4-chlorophenyl)-N-[4-(quinoxalin-2-ylsulfamoyl)phenyl]acetamide

C22H17ClN4O3S — CID 1219828

IUPAC2-(4-chlorophenyl)-N-[4-(quinoxalin-2-ylsulfamoyl)phenyl]acetamide
SMILESO=C(Cc1ccc(Cl)cc1)Nc1ccc(S(=O)(=O)Nc2cnc3ccccc3n2)cc1
InChIInChI=1S/C22H17ClN4O3S/c23-16-7-5-15(6-8-16)13-22(28)25-17-9-11-18(12-10-17)31(29,30)27-21-14-24-19-3-1-2-4-20(19)26-21/h1-12,14H,13H2,(H,25,28)(H,26,27)
InChIKeyHNVUPBPJIZBPTN-UHFFFAOYSA-N
MW452.92 g/mol
LogP4.27
Rot. Bonds6

About 2-(4-chlorophenyl)-N-[4-(quinoxalin-2-ylsulfamoyl)phenyl]acetamide

2-(4-chlorophenyl)-N-[4-(quinoxalin-2-ylsulfamoyl)phenyl]acetamide (PubChem CID 1219828) has the molecular formula C22H17ClN4O3S and a molecular weight of 452.92 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-N-[4-(quinoxalin-2-ylsulfamoyl)phenyl]acetamide.

Molecular Properties

Compound Name2-(4-chlorophenyl)-N-[4-(quinoxalin-2-ylsulfamoyl)phenyl]acetamide
PubChem CID1219828
Molecular FormulaC22H17ClN4O3S
Molecular Weight452.92 g/mol
Exact Mass452.07
IUPAC Name2-(4-chlorophenyl)-N-[4-(quinoxalin-2-ylsulfamoyl)phenyl]acetamide
SMILESO=C(Cc1ccc(Cl)cc1)Nc1ccc(S(=O)(=O)Nc2cnc3ccccc3n2)cc1
InChIInChI=1S/C22H17ClN4O3S/c23-16-7-5-15(6-8-16)13-22(28)25-17-9-11-18(12-10-17)31(29,30)27-21-14-24-19-3-1-2-4-20(19)26-21/h1-12,14H,13H2,(H,25,28)(H,26,27)
InChIKeyHNVUPBPJIZBPTN-UHFFFAOYSA-N
XLogP4.27
TPSA101.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500452.92
LogP ≤ 54.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-N-[4-(quinoxalin-2-ylsulfamoyl)phenyl]acetamide?
The IUPAC name of 2-(4-chlorophenyl)-N-[4-(quinoxalin-2-ylsulfamoyl)phenyl]acetamide (CID 1219828) is 2-(4-chlorophenyl)-N-[4-(quinoxalin-2-ylsulfamoyl)phenyl]acetamide.
What is the SMILES notation for 2-(4-chlorophenyl)-N-[4-(quinoxalin-2-ylsulfamoyl)phenyl]acetamide?
The canonical SMILES for 2-(4-chlorophenyl)-N-[4-(quinoxalin-2-ylsulfamoyl)phenyl]acetamide is O=C(Cc1ccc(Cl)cc1)Nc1ccc(S(=O)(=O)Nc2cnc3ccccc3n2)cc1.
What is the InChIKey of 2-(4-chlorophenyl)-N-[4-(quinoxalin-2-ylsulfamoyl)phenyl]acetamide?
The InChIKey is HNVUPBPJIZBPTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17ClN4O3S/c23-16-7-5-15(6-8-16)13-22(28)25-17-9-11-18(12-10-17)31(29,30)27-21-14-24-19-3-1-2-4-20(19)26-21/h1-12,14H,13H2,(H,25,28)(H,26,27).
What are the key properties of 2-(4-chlorophenyl)-N-[4-(quinoxalin-2-ylsulfamoyl)phenyl]acetamide?
2-(4-chlorophenyl)-N-[4-(quinoxalin-2-ylsulfamoyl)phenyl]acetamide has a molecular weight of 452.92 g/mol, XLogP of 4.27, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-N-[4-(quinoxalin-2-ylsulfamoyl)phenyl]acetamide is sourced from PubChem (CID 1219828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).