N-(4-cyanophenyl)-4-[(2-fluorophenyl)sulfamoyl]benzamide

C20H14FN3O3S — CID 26699329

IUPACN-(4-cyanophenyl)-4-[(2-fluorophenyl)sulfamoyl]benzamide
SMILESN#Cc1ccc(NC(=O)c2ccc(S(=O)(=O)Nc3ccccc3F)cc2)cc1
InChIInChI=1S/C20H14FN3O3S/c21-18-3-1-2-4-19(18)24-28(26,27)17-11-7-15(8-12-17)20(25)23-16-9-5-14(13-22)6-10-16/h1-12,24H,(H,23,25)
InChIKeyJCAZFAWUOROVGI-UHFFFAOYSA-N
MW395.42 g/mol
LogP3.75
Rot. Bonds5

About N-(4-cyanophenyl)-4-[(2-fluorophenyl)sulfamoyl]benzamide

N-(4-cyanophenyl)-4-[(2-fluorophenyl)sulfamoyl]benzamide (PubChem CID 26699329) has the molecular formula C20H14FN3O3S and a molecular weight of 395.42 g/mol. Its IUPAC name is N-(4-cyanophenyl)-4-[(2-fluorophenyl)sulfamoyl]benzamide.

Molecular Properties

Compound NameN-(4-cyanophenyl)-4-[(2-fluorophenyl)sulfamoyl]benzamide
PubChem CID26699329
Molecular FormulaC20H14FN3O3S
Molecular Weight395.42 g/mol
Exact Mass395.07
IUPAC NameN-(4-cyanophenyl)-4-[(2-fluorophenyl)sulfamoyl]benzamide
SMILESN#Cc1ccc(NC(=O)c2ccc(S(=O)(=O)Nc3ccccc3F)cc2)cc1
InChIInChI=1S/C20H14FN3O3S/c21-18-3-1-2-4-19(18)24-28(26,27)17-11-7-15(8-12-17)20(25)23-16-9-5-14(13-22)6-10-16/h1-12,24H,(H,23,25)
InChIKeyJCAZFAWUOROVGI-UHFFFAOYSA-N
XLogP3.75
TPSA99.06 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.42
LogP ≤ 53.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(2-fluorophenyl)sulfamoyl]-N-(4-morpholin-4-ylphenyl)benzamide
CID 4785273
N-(4-cyanophenyl)-4-(propan-2-ylsulfamoyl)benzamide
CID 26698371
2-chloro-5-[[4-[(2-fluorophenyl)sulfamoyl]benzoyl]amino]benzamide
CID 36525049
4-(benzylsulfamoyl)-N-(4-cyanophenyl)benzamide
CID 109060608
4-[(2-cyanophenyl)sulfamoyl]-N-(3-fluorophenyl)benzamide
CID 109061815
4-[(2-fluorophenyl)sulfamoyl]-N-(6-methoxy-3-pyridinyl)benzamide
CID 4801926
N-(4-fluorophenyl)-4-[(2-methylphenyl)sulfamoyl]benzamide
CID 9416298
4-N-(2-cyanophenyl)-1-N-(4-cyanophenyl)benzene-1,4-dicarboxamide
CID 109050250
4-[(2-fluorophenyl)sulfamoyl]-N-(4-methyl-3-nitrophenyl)benzamide
CID 26576215
N-[cyano-(2-fluorophenyl)methyl]-4-[(2-fluorophenyl)sulfamoyl]benzamide
CID 56572373
4-[4-(4-cyanophenyl)-1,4-diazepane-1-carbonyl]-N-(2-fluorophenyl)benzenesulfonamide
CID 55720788
[4-[(2-fluorophenyl)sulfamoyl]phenyl]thiourea
CID 169358585

Frequently Asked Questions

What is the IUPAC name of N-(4-cyanophenyl)-4-[(2-fluorophenyl)sulfamoyl]benzamide?
The IUPAC name of N-(4-cyanophenyl)-4-[(2-fluorophenyl)sulfamoyl]benzamide (CID 26699329) is N-(4-cyanophenyl)-4-[(2-fluorophenyl)sulfamoyl]benzamide.
What is the SMILES notation for N-(4-cyanophenyl)-4-[(2-fluorophenyl)sulfamoyl]benzamide?
The canonical SMILES for N-(4-cyanophenyl)-4-[(2-fluorophenyl)sulfamoyl]benzamide is N#Cc1ccc(NC(=O)c2ccc(S(=O)(=O)Nc3ccccc3F)cc2)cc1.
What is the InChIKey of N-(4-cyanophenyl)-4-[(2-fluorophenyl)sulfamoyl]benzamide?
The InChIKey is JCAZFAWUOROVGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14FN3O3S/c21-18-3-1-2-4-19(18)24-28(26,27)17-11-7-15(8-12-17)20(25)23-16-9-5-14(13-22)6-10-16/h1-12,24H,(H,23,25).
What are the key properties of N-(4-cyanophenyl)-4-[(2-fluorophenyl)sulfamoyl]benzamide?
N-(4-cyanophenyl)-4-[(2-fluorophenyl)sulfamoyl]benzamide has a molecular weight of 395.42 g/mol, XLogP of 3.75, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyanophenyl)-4-[(2-fluorophenyl)sulfamoyl]benzamide is sourced from PubChem (CID 26699329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).