2-phenoxy-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide

C23H18N4O4S — CID 1164331

IUPAC2-phenoxy-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide
SMILESO=C(Nc1ccc(S(=O)(=O)Nc2ncccn2)cc1)c1ccccc1Oc1ccccc1
InChIInChI=1S/C23H18N4O4S/c28-22(20-9-4-5-10-21(20)31-18-7-2-1-3-8-18)26-17-11-13-19(14-12-17)32(29,30)27-23-24-15-6-16-25-23/h1-16H,(H,26,28)(H,24,25,27)
InChIKeyXHOKLZASWGDNPO-UHFFFAOYSA-N
MW446.49 g/mol
LogP4.32
Rot. Bonds7

About 2-phenoxy-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide

2-phenoxy-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide (PubChem CID 1164331) has the molecular formula C23H18N4O4S and a molecular weight of 446.49 g/mol. Its IUPAC name is 2-phenoxy-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide.

Molecular Properties

Compound Name2-phenoxy-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide
PubChem CID1164331
Molecular FormulaC23H18N4O4S
Molecular Weight446.49 g/mol
Exact Mass446.10
IUPAC Name2-phenoxy-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide
SMILESO=C(Nc1ccc(S(=O)(=O)Nc2ncccn2)cc1)c1ccccc1Oc1ccccc1
InChIInChI=1S/C23H18N4O4S/c28-22(20-9-4-5-10-21(20)31-18-7-2-1-3-8-18)26-17-11-13-19(14-12-17)32(29,30)27-23-24-15-6-16-25-23/h1-16H,(H,26,28)(H,24,25,27)
InChIKeyXHOKLZASWGDNPO-UHFFFAOYSA-N
XLogP4.32
TPSA110.28 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500446.49
LogP ≤ 54.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-phenoxy-N-[4-(propan-2-ylsulfamoyl)phenyl]benzamide
CID 8752850
2-phenoxy-N-phenylbenzamide
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2-benzylsulfanyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide
CID 92675622
2-ethoxy-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide
CID 1078176
2-phenoxy-N-(4-phenylphenyl)benzamide
CID 7926007
2-phenoxy-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]propanamide
CID 3148025
2,2-diphenyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]acetamide
CID 4185684
2-(benzenesulfonamido)-N-(4-phenoxyphenyl)benzamide
CID 3900171
2-(2-methylpropoxy)-N-[4-(phenylsulfamoyl)phenyl]benzamide
CID 4945295
2-(2-phenoxyethoxy)-N-[4-(propylsulfamoyl)phenyl]benzamide
CID 4954384
N-[[4-(pyrimidin-2-ylsulfamoyl)phenyl]carbamoyl]benzamide
CID 1179236

Frequently Asked Questions

What is the IUPAC name of 2-phenoxy-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide?
The IUPAC name of 2-phenoxy-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide (CID 1164331) is 2-phenoxy-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide.
What is the SMILES notation for 2-phenoxy-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide?
The canonical SMILES for 2-phenoxy-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide is O=C(Nc1ccc(S(=O)(=O)Nc2ncccn2)cc1)c1ccccc1Oc1ccccc1.
What is the InChIKey of 2-phenoxy-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide?
The InChIKey is XHOKLZASWGDNPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18N4O4S/c28-22(20-9-4-5-10-21(20)31-18-7-2-1-3-8-18)26-17-11-13-19(14-12-17)32(29,30)27-23-24-15-6-16-25-23/h1-16H,(H,26,28)(H,24,25,27).
What are the key properties of 2-phenoxy-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide?
2-phenoxy-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide has a molecular weight of 446.49 g/mol, XLogP of 4.32, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenoxy-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide is sourced from PubChem (CID 1164331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).