3-[(4-fluorophenyl)sulfonylamino]-N-(2-phenoxyphenyl)benzamide

C25H19FN2O4S — CID 121042034

IUPAC3-[(4-fluorophenyl)sulfonylamino]-N-(2-phenoxyphenyl)benzamide
SMILESO=C(Nc1ccccc1Oc1ccccc1)c1cccc(NS(=O)(=O)c2ccc(F)cc2)c1
InChIInChI=1S/C25H19FN2O4S/c26-19-13-15-22(16-14-19)33(30,31)28-20-8-6-7-18(17-20)25(29)27-23-11-4-5-12-24(23)32-21-9-2-1-3-10-21/h1-17,28H,(H,27,29)
InChIKeyWZDQGQODDLUNDL-UHFFFAOYSA-N
MW462.50 g/mol
LogP5.67
Rot. Bonds7

About 3-[(4-fluorophenyl)sulfonylamino]-N-(2-phenoxyphenyl)benzamide

3-[(4-fluorophenyl)sulfonylamino]-N-(2-phenoxyphenyl)benzamide (PubChem CID 121042034) has the molecular formula C25H19FN2O4S and a molecular weight of 462.50 g/mol. Its IUPAC name is 3-[(4-fluorophenyl)sulfonylamino]-N-(2-phenoxyphenyl)benzamide.

Molecular Properties

Compound Name3-[(4-fluorophenyl)sulfonylamino]-N-(2-phenoxyphenyl)benzamide
PubChem CID121042034
Molecular FormulaC25H19FN2O4S
Molecular Weight462.50 g/mol
Exact Mass462.10
IUPAC Name3-[(4-fluorophenyl)sulfonylamino]-N-(2-phenoxyphenyl)benzamide
SMILESO=C(Nc1ccccc1Oc1ccccc1)c1cccc(NS(=O)(=O)c2ccc(F)cc2)c1
InChIInChI=1S/C25H19FN2O4S/c26-19-13-15-22(16-14-19)33(30,31)28-20-8-6-7-18(17-20)25(29)27-23-11-4-5-12-24(23)32-21-9-2-1-3-10-21/h1-17,28H,(H,27,29)
InChIKeyWZDQGQODDLUNDL-UHFFFAOYSA-N
XLogP5.67
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500462.50
LogP ≤ 55.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(benzenesulfonamido)-N-(2-hydroxyphenyl)benzamide
CID 35979337
3-fluoro-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]benzamide
CID 78805836
4-(benzenesulfonamido)-3-chloro-N-(2-phenoxyphenyl)benzamide
CID 92672200
3-[(4-phenoxyphenyl)sulfonylamino]benzoic acid
CID 44669190
4-(benzenesulfonamido)-2-chloro-N-(2-phenoxyphenyl)benzamide
CID 99958448
3-(benzenesulfonamido)-N-(3-methoxyphenyl)benzamide
CID 7541945
3-(benzenesulfonamido)-N-(2-methylphenyl)benzamide
CID 9341944
N-(3-benzamidophenyl)-2-[(4-fluorophenyl)sulfonylamino]benzamide
CID 55869973
3-[(3-fluoro-4-methylphenyl)sulfonylamino]-N-[2-(trifluoromethoxy)phenyl]benzamide
CID 134050501
3-[[3-[(3-phenoxyphenyl)sulfamoyl]benzoyl]amino]benzamide
CID 142738706
N-methyl-3-[[3-[(3-phenoxyphenyl)sulfamoyl]benzoyl]amino]benzamide
CID 142738756
N-[2-(difluoromethoxy)phenyl]-4-[(4-fluorophenyl)sulfonylamino]benzamide
CID 37312010

Frequently Asked Questions

What is the IUPAC name of 3-[(4-fluorophenyl)sulfonylamino]-N-(2-phenoxyphenyl)benzamide?
The IUPAC name of 3-[(4-fluorophenyl)sulfonylamino]-N-(2-phenoxyphenyl)benzamide (CID 121042034) is 3-[(4-fluorophenyl)sulfonylamino]-N-(2-phenoxyphenyl)benzamide.
What is the SMILES notation for 3-[(4-fluorophenyl)sulfonylamino]-N-(2-phenoxyphenyl)benzamide?
The canonical SMILES for 3-[(4-fluorophenyl)sulfonylamino]-N-(2-phenoxyphenyl)benzamide is O=C(Nc1ccccc1Oc1ccccc1)c1cccc(NS(=O)(=O)c2ccc(F)cc2)c1.
What is the InChIKey of 3-[(4-fluorophenyl)sulfonylamino]-N-(2-phenoxyphenyl)benzamide?
The InChIKey is WZDQGQODDLUNDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H19FN2O4S/c26-19-13-15-22(16-14-19)33(30,31)28-20-8-6-7-18(17-20)25(29)27-23-11-4-5-12-24(23)32-21-9-2-1-3-10-21/h1-17,28H,(H,27,29).
What are the key properties of 3-[(4-fluorophenyl)sulfonylamino]-N-(2-phenoxyphenyl)benzamide?
3-[(4-fluorophenyl)sulfonylamino]-N-(2-phenoxyphenyl)benzamide has a molecular weight of 462.50 g/mol, XLogP of 5.67, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-fluorophenyl)sulfonylamino]-N-(2-phenoxyphenyl)benzamide is sourced from PubChem (CID 121042034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).