3-fluoro-4-methoxy-N-(2-phenylphenyl)benzenesulfonamide

C19H16FNO3S — CID 39825493

IUPAC3-fluoro-4-methoxy-N-(2-phenylphenyl)benzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)Nc2ccccc2-c2ccccc2)cc1F
InChIInChI=1S/C19H16FNO3S/c1-24-19-12-11-15(13-17(19)20)25(22,23)21-18-10-6-5-9-16(18)14-7-3-2-4-8-14/h2-13,21H,1H3
InChIKeyZAZTWJUAUWEXDS-UHFFFAOYSA-N
MW357.41 g/mol
LogP4.30
Rot. Bonds5

About 3-fluoro-4-methoxy-N-(2-phenylphenyl)benzenesulfonamide

3-fluoro-4-methoxy-N-(2-phenylphenyl)benzenesulfonamide (PubChem CID 39825493) has the molecular formula C19H16FNO3S and a molecular weight of 357.41 g/mol. Its IUPAC name is 3-fluoro-4-methoxy-N-(2-phenylphenyl)benzenesulfonamide.

Molecular Properties

Compound Name3-fluoro-4-methoxy-N-(2-phenylphenyl)benzenesulfonamide
PubChem CID39825493
Molecular FormulaC19H16FNO3S
Molecular Weight357.41 g/mol
Exact Mass357.08
IUPAC Name3-fluoro-4-methoxy-N-(2-phenylphenyl)benzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)Nc2ccccc2-c2ccccc2)cc1F
InChIInChI=1S/C19H16FNO3S/c1-24-19-12-11-15(13-17(19)20)25(22,23)21-18-10-6-5-9-16(18)14-7-3-2-4-8-14/h2-13,21H,1H3
InChIKeyZAZTWJUAUWEXDS-UHFFFAOYSA-N
XLogP4.30
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.41
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-methoxy-3-nitro-N-(2-phenylphenyl)benzenesulfonamide
CID 7939180
3-fluoro-N-(2-methoxyphenyl)-4-propan-2-yloxybenzenesulfonamide
CID 110758242
3-fluoro-4-methoxy-N-(2-methoxy-5-methylphenyl)benzenesulfonamide
CID 39825262
2-methoxy-5-methyl-N-(2-phenylphenyl)benzenesulfonamide
CID 8514631
N-(2-fluorophenyl)-4-methoxy-3-methylbenzenesulfonamide
CID 40727137
3-fluoro-4-methoxy-N-(2,4,5-trichlorophenyl)benzenesulfonamide
CID 112811750
N-(2,5-dichlorophenyl)-3-fluoro-4-methoxybenzenesulfonamide
CID 19109274
3-chloro-N-(2-fluorophenyl)-4-methoxybenzenesulfonamide
CID 974272
4-amino-3-fluoro-N-(2-methoxyphenyl)benzenesulfonamide
CID 82843777
5-[(2-fluorophenyl)sulfamoyl]-2-methoxybenzoic acid
CID 56812258
3-methyl-N-(2-phenylphenyl)benzenesulfonamide
CID 3384228
N-(2-chloro-5-methyl-3-pyridinyl)-3-fluoro-4-methoxybenzenesulfonamide
CID 102976123

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-4-methoxy-N-(2-phenylphenyl)benzenesulfonamide?
The IUPAC name of 3-fluoro-4-methoxy-N-(2-phenylphenyl)benzenesulfonamide (CID 39825493) is 3-fluoro-4-methoxy-N-(2-phenylphenyl)benzenesulfonamide.
What is the SMILES notation for 3-fluoro-4-methoxy-N-(2-phenylphenyl)benzenesulfonamide?
The canonical SMILES for 3-fluoro-4-methoxy-N-(2-phenylphenyl)benzenesulfonamide is COc1ccc(S(=O)(=O)Nc2ccccc2-c2ccccc2)cc1F.
What is the InChIKey of 3-fluoro-4-methoxy-N-(2-phenylphenyl)benzenesulfonamide?
The InChIKey is ZAZTWJUAUWEXDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16FNO3S/c1-24-19-12-11-15(13-17(19)20)25(22,23)21-18-10-6-5-9-16(18)14-7-3-2-4-8-14/h2-13,21H,1H3.
What are the key properties of 3-fluoro-4-methoxy-N-(2-phenylphenyl)benzenesulfonamide?
3-fluoro-4-methoxy-N-(2-phenylphenyl)benzenesulfonamide has a molecular weight of 357.41 g/mol, XLogP of 4.30, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-4-methoxy-N-(2-phenylphenyl)benzenesulfonamide is sourced from PubChem (CID 39825493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).