N-[4-[(4-chlorophenyl)sulfamoyl]phenyl]-3-fluorobenzamide

C19H14ClFN2O3S — CID 94783605

IUPACN-[4-[(4-chlorophenyl)sulfamoyl]phenyl]-3-fluorobenzamide
SMILESO=C(Nc1ccc(S(=O)(=O)Nc2ccc(Cl)cc2)cc1)c1cccc(F)c1
InChIInChI=1S/C19H14ClFN2O3S/c20-14-4-6-17(7-5-14)23-27(25,26)18-10-8-16(9-11-18)22-19(24)13-2-1-3-15(21)12-13/h1-12,23H,(H,22,24)
InChIKeyMIFUTOMKYXFNBJ-UHFFFAOYSA-N
MW404.85 g/mol
LogP4.53
Rot. Bonds5

About N-[4-[(4-chlorophenyl)sulfamoyl]phenyl]-3-fluorobenzamide

N-[4-[(4-chlorophenyl)sulfamoyl]phenyl]-3-fluorobenzamide (PubChem CID 94783605) has the molecular formula C19H14ClFN2O3S and a molecular weight of 404.85 g/mol. Its IUPAC name is N-[4-[(4-chlorophenyl)sulfamoyl]phenyl]-3-fluorobenzamide.

Molecular Properties

Compound NameN-[4-[(4-chlorophenyl)sulfamoyl]phenyl]-3-fluorobenzamide
PubChem CID94783605
Molecular FormulaC19H14ClFN2O3S
Molecular Weight404.85 g/mol
Exact Mass404.04
IUPAC NameN-[4-[(4-chlorophenyl)sulfamoyl]phenyl]-3-fluorobenzamide
SMILESO=C(Nc1ccc(S(=O)(=O)Nc2ccc(Cl)cc2)cc1)c1cccc(F)c1
InChIInChI=1S/C19H14ClFN2O3S/c20-14-4-6-17(7-5-14)23-27(25,26)18-10-8-16(9-11-18)22-19(24)13-2-1-3-15(21)12-13/h1-12,23H,(H,22,24)
InChIKeyMIFUTOMKYXFNBJ-UHFFFAOYSA-N
XLogP4.53
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.85
LogP ≤ 54.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-chlorophenyl)-3-[[(3-fluorobenzoyl)amino]carbamoyl]benzenesulfonamide
CID 24642831
N-[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]-3-fluorobenzamide
CID 55865230
3-fluoro-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide
CID 2521510
N-(4-bromophenyl)-3-[(4-chlorophenyl)sulfamoyl]benzamide
CID 1087366
3,5-difluoro-N-[4-(phenylsulfamoyl)phenyl]benzamide
CID 24638196
N-(4-acetylphenyl)-3-[(4-chlorophenyl)sulfamoyl]benzamide
CID 26663686
N-(3-chlorophenyl)-4-[(4-fluorophenyl)sulfonylamino]benzamide
CID 7553525
N-[4-[(4-chlorophenyl)sulfamoyl]phenyl]-2,4,5-trifluorobenzamide
CID 167860654
N-[3-[(4-chlorophenyl)sulfonylamino]phenyl]benzamide
CID 1216913
4-chloro-N-[4-[[4-(trifluoromethyl)phenyl]sulfamoyl]phenyl]benzamide
CID 2730887
4-[(4-bromophenyl)sulfonylamino]-N-(4-chlorophenyl)benzamide
CID 3868276
N-(4-chlorophenyl)-4-[(4-methylphenyl)sulfonylamino]benzamide
CID 7720348

Frequently Asked Questions

What is the IUPAC name of N-[4-[(4-chlorophenyl)sulfamoyl]phenyl]-3-fluorobenzamide?
The IUPAC name of N-[4-[(4-chlorophenyl)sulfamoyl]phenyl]-3-fluorobenzamide (CID 94783605) is N-[4-[(4-chlorophenyl)sulfamoyl]phenyl]-3-fluorobenzamide.
What is the SMILES notation for N-[4-[(4-chlorophenyl)sulfamoyl]phenyl]-3-fluorobenzamide?
The canonical SMILES for N-[4-[(4-chlorophenyl)sulfamoyl]phenyl]-3-fluorobenzamide is O=C(Nc1ccc(S(=O)(=O)Nc2ccc(Cl)cc2)cc1)c1cccc(F)c1.
What is the InChIKey of N-[4-[(4-chlorophenyl)sulfamoyl]phenyl]-3-fluorobenzamide?
The InChIKey is MIFUTOMKYXFNBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14ClFN2O3S/c20-14-4-6-17(7-5-14)23-27(25,26)18-10-8-16(9-11-18)22-19(24)13-2-1-3-15(21)12-13/h1-12,23H,(H,22,24).
What are the key properties of N-[4-[(4-chlorophenyl)sulfamoyl]phenyl]-3-fluorobenzamide?
N-[4-[(4-chlorophenyl)sulfamoyl]phenyl]-3-fluorobenzamide has a molecular weight of 404.85 g/mol, XLogP of 4.53, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(4-chlorophenyl)sulfamoyl]phenyl]-3-fluorobenzamide is sourced from PubChem (CID 94783605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).