N-[4-(4-fluorobenzoyl)phenyl]benzenesulfonamide

C19H14FNO3S — CID 21205051

IUPACN-[4-(4-fluorobenzoyl)phenyl]benzenesulfonamide
SMILESO=C(c1ccc(F)cc1)c1ccc(NS(=O)(=O)c2ccccc2)cc1
InChIInChI=1S/C19H14FNO3S/c20-16-10-6-14(7-11-16)19(22)15-8-12-17(13-9-15)21-25(23,24)18-4-2-1-3-5-18/h1-13,21H
InChIKeyBJSYDPLPQQMERG-UHFFFAOYSA-N
MW355.39 g/mol
LogP3.86
Rot. Bonds5

About N-[4-(4-fluorobenzoyl)phenyl]benzenesulfonamide

N-[4-(4-fluorobenzoyl)phenyl]benzenesulfonamide (PubChem CID 21205051) has the molecular formula C19H14FNO3S and a molecular weight of 355.39 g/mol. Its IUPAC name is N-[4-(4-fluorobenzoyl)phenyl]benzenesulfonamide.

Molecular Properties

Compound NameN-[4-(4-fluorobenzoyl)phenyl]benzenesulfonamide
PubChem CID21205051
Molecular FormulaC19H14FNO3S
Molecular Weight355.39 g/mol
Exact Mass355.07
IUPAC NameN-[4-(4-fluorobenzoyl)phenyl]benzenesulfonamide
SMILESO=C(c1ccc(F)cc1)c1ccc(NS(=O)(=O)c2ccccc2)cc1
InChIInChI=1S/C19H14FNO3S/c20-16-10-6-14(7-11-16)19(22)15-8-12-17(13-9-15)21-25(23,24)18-4-2-1-3-5-18/h1-13,21H
InChIKeyBJSYDPLPQQMERG-UHFFFAOYSA-N
XLogP3.86
TPSA63.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.39
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-N-[4-(4-fluorobenzoyl)phenyl]benzenesulfonamide
CID 1375859
4-[(4-fluorophenyl)sulfamoyl]benzoic acid
CID 2345459
4-[(4-fluorophenyl)sulfamoyl]benzamide
CID 2098781
N-(4-fluorophenyl)-4-[(4-phenylphenyl)sulfonylamino]benzamide
CID 46386313
4-[(4-fluorophenyl)sulfonylamino]-N-methyl-N-phenylbenzamide
CID 51161114
N-[4-[[[2-(4-fluorophenyl)acetyl]amino]carbamoyl]phenyl]benzenesulfonamide
CID 46521478
4-[(4-fluorophenyl)sulfonylamino]-N-[(1R)-1-phenylethyl]benzamide
CID 9315283
4-[(4-fluorophenyl)sulfonylamino]-N-[(1S)-1-phenylethyl]benzamide
CID 9315282
N-[4-(2-bromoacetyl)phenyl]-4-fluorobenzenesulfonamide
CID 4737379
4-(benzenesulfonamido)-N-[4-[(4-fluorophenyl)sulfamoyl]phenyl]-3-methylbenzamide
CID 19062739
4-(benzenesulfonamido)-N-phenylbenzenesulfonamide
CID 1333712
4-fluoro-N-[4-(2-phenylethynyl)phenyl]benzenesulfonamide
CID 1472868

Frequently Asked Questions

What is the IUPAC name of N-[4-(4-fluorobenzoyl)phenyl]benzenesulfonamide?
The IUPAC name of N-[4-(4-fluorobenzoyl)phenyl]benzenesulfonamide (CID 21205051) is N-[4-(4-fluorobenzoyl)phenyl]benzenesulfonamide.
What is the SMILES notation for N-[4-(4-fluorobenzoyl)phenyl]benzenesulfonamide?
The canonical SMILES for N-[4-(4-fluorobenzoyl)phenyl]benzenesulfonamide is O=C(c1ccc(F)cc1)c1ccc(NS(=O)(=O)c2ccccc2)cc1.
What is the InChIKey of N-[4-(4-fluorobenzoyl)phenyl]benzenesulfonamide?
The InChIKey is BJSYDPLPQQMERG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14FNO3S/c20-16-10-6-14(7-11-16)19(22)15-8-12-17(13-9-15)21-25(23,24)18-4-2-1-3-5-18/h1-13,21H.
What are the key properties of N-[4-(4-fluorobenzoyl)phenyl]benzenesulfonamide?
N-[4-(4-fluorobenzoyl)phenyl]benzenesulfonamide has a molecular weight of 355.39 g/mol, XLogP of 3.86, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-fluorobenzoyl)phenyl]benzenesulfonamide is sourced from PubChem (CID 21205051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).