4-(4-benzoylphenyl)benzenesulfonamide

C19H15NO3S — CID 122194775

IUPAC4-(4-benzoylphenyl)benzenesulfonamide
SMILESNS(=O)(=O)c1ccc(-c2ccc(C(=O)c3ccccc3)cc2)cc1
InChIInChI=1S/C19H15NO3S/c20-24(22,23)18-12-10-15(11-13-18)14-6-8-17(9-7-14)19(21)16-4-2-1-3-5-16/h1-13H,(H2,20,22,23)
InChIKeyLRYBCKXOOIKQND-UHFFFAOYSA-N
MW337.40 g/mol
LogP3.23
Rot. Bonds4

About 4-(4-benzoylphenyl)benzenesulfonamide

4-(4-benzoylphenyl)benzenesulfonamide (PubChem CID 122194775) has the molecular formula C19H15NO3S and a molecular weight of 337.40 g/mol. Its IUPAC name is 4-(4-benzoylphenyl)benzenesulfonamide.

Molecular Properties

Compound Name4-(4-benzoylphenyl)benzenesulfonamide
PubChem CID122194775
Molecular FormulaC19H15NO3S
Molecular Weight337.40 g/mol
Exact Mass337.08
IUPAC Name4-(4-benzoylphenyl)benzenesulfonamide
SMILESNS(=O)(=O)c1ccc(-c2ccc(C(=O)c3ccccc3)cc2)cc1
InChIInChI=1S/C19H15NO3S/c20-24(22,23)18-12-10-15(11-13-18)14-6-8-17(9-7-14)19(21)16-4-2-1-3-5-16/h1-13H,(H2,20,22,23)
InChIKeyLRYBCKXOOIKQND-UHFFFAOYSA-N
XLogP3.23
TPSA77.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.40
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(4-benzoylphenyl)benzenesulfonamide?
The IUPAC name of 4-(4-benzoylphenyl)benzenesulfonamide (CID 122194775) is 4-(4-benzoylphenyl)benzenesulfonamide.
What is the SMILES notation for 4-(4-benzoylphenyl)benzenesulfonamide?
The canonical SMILES for 4-(4-benzoylphenyl)benzenesulfonamide is NS(=O)(=O)c1ccc(-c2ccc(C(=O)c3ccccc3)cc2)cc1.
What is the InChIKey of 4-(4-benzoylphenyl)benzenesulfonamide?
The InChIKey is LRYBCKXOOIKQND-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15NO3S/c20-24(22,23)18-12-10-15(11-13-18)14-6-8-17(9-7-14)19(21)16-4-2-1-3-5-16/h1-13H,(H2,20,22,23).
What are the key properties of 4-(4-benzoylphenyl)benzenesulfonamide?
4-(4-benzoylphenyl)benzenesulfonamide has a molecular weight of 337.40 g/mol, XLogP of 3.23, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-benzoylphenyl)benzenesulfonamide is sourced from PubChem (CID 122194775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).