2,2-diphenyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]acetamide

C24H20N4O3S — CID 4185684

IUPAC2,2-diphenyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]acetamide
SMILESO=C(Nc1ccc(S(=O)(=O)Nc2ncccn2)cc1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C24H20N4O3S/c29-23(22(18-8-3-1-4-9-18)19-10-5-2-6-11-19)27-20-12-14-21(15-13-20)32(30,31)28-24-25-16-7-17-26-24/h1-17,22H,(H,27,29)(H,25,26,28)
InChIKeyVNSHAEAQBWQFGC-UHFFFAOYSA-N
MW444.52 g/mol
LogP4.05
Rot. Bonds7

About 2,2-diphenyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]acetamide

2,2-diphenyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]acetamide (PubChem CID 4185684) has the molecular formula C24H20N4O3S and a molecular weight of 444.52 g/mol. Its IUPAC name is 2,2-diphenyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]acetamide.

Molecular Properties

Compound Name2,2-diphenyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]acetamide
PubChem CID4185684
Molecular FormulaC24H20N4O3S
Molecular Weight444.52 g/mol
Exact Mass444.13
IUPAC Name2,2-diphenyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]acetamide
SMILESO=C(Nc1ccc(S(=O)(=O)Nc2ncccn2)cc1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C24H20N4O3S/c29-23(22(18-8-3-1-4-9-18)19-10-5-2-6-11-19)27-20-12-14-21(15-13-20)32(30,31)28-24-25-16-7-17-26-24/h1-17,22H,(H,27,29)(H,25,26,28)
InChIKeyVNSHAEAQBWQFGC-UHFFFAOYSA-N
XLogP4.05
TPSA101.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms32
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500444.52
LogP ≤ 54.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2,2-diphenyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]acetamide?
The IUPAC name of 2,2-diphenyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]acetamide (CID 4185684) is 2,2-diphenyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]acetamide.
What is the SMILES notation for 2,2-diphenyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]acetamide?
The canonical SMILES for 2,2-diphenyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]acetamide is O=C(Nc1ccc(S(=O)(=O)Nc2ncccn2)cc1)C(c1ccccc1)c1ccccc1.
What is the InChIKey of 2,2-diphenyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]acetamide?
The InChIKey is VNSHAEAQBWQFGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20N4O3S/c29-23(22(18-8-3-1-4-9-18)19-10-5-2-6-11-19)27-20-12-14-21(15-13-20)32(30,31)28-24-25-16-7-17-26-24/h1-17,22H,(H,27,29)(H,25,26,28).
What are the key properties of 2,2-diphenyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]acetamide?
2,2-diphenyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]acetamide has a molecular weight of 444.52 g/mol, XLogP of 4.05, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-diphenyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]acetamide is sourced from PubChem (CID 4185684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).