N-benzyl-4-[(4-phenylphenyl)sulfonylamino]benzamide

C26H22N2O3S — CID 46386320

IUPACN-benzyl-4-[(4-phenylphenyl)sulfonylamino]benzamide
SMILESO=C(NCc1ccccc1)c1ccc(NS(=O)(=O)c2ccc(-c3ccccc3)cc2)cc1
InChIInChI=1S/C26H22N2O3S/c29-26(27-19-20-7-3-1-4-8-20)23-11-15-24(16-12-23)28-32(30,31)25-17-13-22(14-18-25)21-9-5-2-6-10-21/h1-18,28H,19H2,(H,27,29)
InChIKeyFFYNNRVRBYYXPK-UHFFFAOYSA-N
MW442.54 g/mol
LogP5.08
Rot. Bonds7

About N-benzyl-4-[(4-phenylphenyl)sulfonylamino]benzamide

N-benzyl-4-[(4-phenylphenyl)sulfonylamino]benzamide (PubChem CID 46386320) has the molecular formula C26H22N2O3S and a molecular weight of 442.54 g/mol. Its IUPAC name is N-benzyl-4-[(4-phenylphenyl)sulfonylamino]benzamide.

Molecular Properties

Compound NameN-benzyl-4-[(4-phenylphenyl)sulfonylamino]benzamide
PubChem CID46386320
Molecular FormulaC26H22N2O3S
Molecular Weight442.54 g/mol
Exact Mass442.14
IUPAC NameN-benzyl-4-[(4-phenylphenyl)sulfonylamino]benzamide
SMILESO=C(NCc1ccccc1)c1ccc(NS(=O)(=O)c2ccc(-c3ccccc3)cc2)cc1
InChIInChI=1S/C26H22N2O3S/c29-26(27-19-20-7-3-1-4-8-20)23-11-15-24(16-12-23)28-32(30,31)25-17-13-22(14-18-25)21-9-5-2-6-10-21/h1-18,28H,19H2,(H,27,29)
InChIKeyFFYNNRVRBYYXPK-UHFFFAOYSA-N
XLogP5.08
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500442.54
LogP ≤ 55.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-benzyl-4-[[4-(3-fluorophenyl)phenyl]sulfonylamino]benzamide
CID 46386301
4-(benzenesulfonamido)-N-[[4-(methylsulfonylmethyl)phenyl]methyl]benzamide
CID 55947241
N-[(4-cyanophenyl)methyl]-4-(phenylsulfamoyl)benzamide
CID 134035426
N-(furan-3-ylmethyl)-4-(phenylsulfamoyl)benzamide
CID 55700082
4-[(4-fluorophenyl)sulfamoyl]-N-[(4-methylphenyl)methyl]benzamide
CID 26850932
4-(benzenesulfonamido)-N-[[4-(diethylaminomethyl)phenyl]methyl]benzamide
CID 55428597
4-(phenylsulfamoyl)-N-[[3-(trifluoromethyl)phenyl]methyl]benzamide
CID 2105846
N-benzyl-4-(2-methylpropylsulfamoyl)benzamide
CID 109058915
N-(4-fluorophenyl)-4-[(4-phenylphenyl)sulfonylamino]benzamide
CID 46386313
3-[(4-acetamidophenyl)sulfonylamino]-N-benzylbenzamide
CID 17377321
N-cyclopentyl-4-[(4-phenylphenyl)sulfonylamino]benzamide
CID 46386307
N-benzyl-3-[(4-bromophenyl)sulfamoyl]benzamide
CID 561600

Frequently Asked Questions

What is the IUPAC name of N-benzyl-4-[(4-phenylphenyl)sulfonylamino]benzamide?
The IUPAC name of N-benzyl-4-[(4-phenylphenyl)sulfonylamino]benzamide (CID 46386320) is N-benzyl-4-[(4-phenylphenyl)sulfonylamino]benzamide.
What is the SMILES notation for N-benzyl-4-[(4-phenylphenyl)sulfonylamino]benzamide?
The canonical SMILES for N-benzyl-4-[(4-phenylphenyl)sulfonylamino]benzamide is O=C(NCc1ccccc1)c1ccc(NS(=O)(=O)c2ccc(-c3ccccc3)cc2)cc1.
What is the InChIKey of N-benzyl-4-[(4-phenylphenyl)sulfonylamino]benzamide?
The InChIKey is FFYNNRVRBYYXPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H22N2O3S/c29-26(27-19-20-7-3-1-4-8-20)23-11-15-24(16-12-23)28-32(30,31)25-17-13-22(14-18-25)21-9-5-2-6-10-21/h1-18,28H,19H2,(H,27,29).
What are the key properties of N-benzyl-4-[(4-phenylphenyl)sulfonylamino]benzamide?
N-benzyl-4-[(4-phenylphenyl)sulfonylamino]benzamide has a molecular weight of 442.54 g/mol, XLogP of 5.08, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-4-[(4-phenylphenyl)sulfonylamino]benzamide is sourced from PubChem (CID 46386320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).