N-(3-fluorophenyl)-4-[(4-methoxyphenyl)sulfamoyl]benzamide

C20H17FN2O4S — CID 26579550

IUPACN-(3-fluorophenyl)-4-[(4-methoxyphenyl)sulfamoyl]benzamide
SMILESCOc1ccc(NS(=O)(=O)c2ccc(C(=O)Nc3cccc(F)c3)cc2)cc1
InChIInChI=1S/C20H17FN2O4S/c1-27-18-9-7-16(8-10-18)23-28(25,26)19-11-5-14(6-12-19)20(24)22-17-4-2-3-15(21)13-17/h2-13,23H,1H3,(H,22,24)
InChIKeyNRRCBBPHMIUBMG-UHFFFAOYSA-N
MW400.43 g/mol
LogP3.89
Rot. Bonds6

About N-(3-fluorophenyl)-4-[(4-methoxyphenyl)sulfamoyl]benzamide

N-(3-fluorophenyl)-4-[(4-methoxyphenyl)sulfamoyl]benzamide (PubChem CID 26579550) has the molecular formula C20H17FN2O4S and a molecular weight of 400.43 g/mol. Its IUPAC name is N-(3-fluorophenyl)-4-[(4-methoxyphenyl)sulfamoyl]benzamide.

Molecular Properties

Compound NameN-(3-fluorophenyl)-4-[(4-methoxyphenyl)sulfamoyl]benzamide
PubChem CID26579550
Molecular FormulaC20H17FN2O4S
Molecular Weight400.43 g/mol
Exact Mass400.09
IUPAC NameN-(3-fluorophenyl)-4-[(4-methoxyphenyl)sulfamoyl]benzamide
SMILESCOc1ccc(NS(=O)(=O)c2ccc(C(=O)Nc3cccc(F)c3)cc2)cc1
InChIInChI=1S/C20H17FN2O4S/c1-27-18-9-7-16(8-10-18)23-28(25,26)19-11-5-14(6-12-19)20(24)22-17-4-2-3-15(21)13-17/h2-13,23H,1H3,(H,22,24)
InChIKeyNRRCBBPHMIUBMG-UHFFFAOYSA-N
XLogP3.89
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.43
LogP ≤ 53.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-methoxyphenyl)-4-[(4-methoxyphenyl)sulfonylamino]benzamide
CID 7553556
N-(3-methoxyphenyl)-4-(phenylsulfamoyl)benzamide
CID 27167578
4-[(3,4-dimethylphenyl)sulfamoyl]-N-(3-fluorophenyl)benzamide
CID 26579304
N-(3,4-dimethylphenyl)-4-[(4-methoxyphenyl)sulfamoyl]benzamide
CID 26593901
N-(3,4-dimethoxyphenyl)-4-[(4-methoxyphenyl)sulfamoyl]benzamide
CID 26695232
N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]benzamide
CID 4213453
4-[(4-ethoxyphenyl)sulfamoyl]-N-(3-methoxyphenyl)benzamide
CID 27167584
4-[(4-fluoro-3-methylphenyl)sulfonylamino]-N-(4-methoxyphenyl)benzamide
CID 17391179
3-fluoro-N-[4-methoxy-3-[(4-methoxyphenyl)sulfamoyl]phenyl]benzamide
CID 26851586
3-[(4-methoxyphenyl)sulfonylamino]-N-[4-[4-[[3-[(4-methoxyphenyl)sulfonylamino]benzoyl]amino]phenyl]phenyl]benzamide
CID 121043305
3-methoxy-N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]benzamide
CID 5156929
methyl 3-[[4-[(4-methoxyphenyl)sulfamoyl]phenyl]carbamoyl]benzoate
CID 17175147

Frequently Asked Questions

What is the IUPAC name of N-(3-fluorophenyl)-4-[(4-methoxyphenyl)sulfamoyl]benzamide?
The IUPAC name of N-(3-fluorophenyl)-4-[(4-methoxyphenyl)sulfamoyl]benzamide (CID 26579550) is N-(3-fluorophenyl)-4-[(4-methoxyphenyl)sulfamoyl]benzamide.
What is the SMILES notation for N-(3-fluorophenyl)-4-[(4-methoxyphenyl)sulfamoyl]benzamide?
The canonical SMILES for N-(3-fluorophenyl)-4-[(4-methoxyphenyl)sulfamoyl]benzamide is COc1ccc(NS(=O)(=O)c2ccc(C(=O)Nc3cccc(F)c3)cc2)cc1.
What is the InChIKey of N-(3-fluorophenyl)-4-[(4-methoxyphenyl)sulfamoyl]benzamide?
The InChIKey is NRRCBBPHMIUBMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17FN2O4S/c1-27-18-9-7-16(8-10-18)23-28(25,26)19-11-5-14(6-12-19)20(24)22-17-4-2-3-15(21)13-17/h2-13,23H,1H3,(H,22,24).
What are the key properties of N-(3-fluorophenyl)-4-[(4-methoxyphenyl)sulfamoyl]benzamide?
N-(3-fluorophenyl)-4-[(4-methoxyphenyl)sulfamoyl]benzamide has a molecular weight of 400.43 g/mol, XLogP of 3.89, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluorophenyl)-4-[(4-methoxyphenyl)sulfamoyl]benzamide is sourced from PubChem (CID 26579550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).