N-dibenzofuran-2-yl-4-methylsulfonylbenzamide

C20H15NO4S — CID 18081219

IUPACN-dibenzofuran-2-yl-4-methylsulfonylbenzamide
SMILESCS(=O)(=O)c1ccc(C(=O)Nc2ccc3oc4ccccc4c3c2)cc1
InChIInChI=1S/C20H15NO4S/c1-26(23,24)15-9-6-13(7-10-15)20(22)21-14-8-11-19-17(12-14)16-4-2-3-5-18(16)25-19/h2-12H,1H3,(H,21,22)
InChIKeyXYVNLPTVCMYNFJ-UHFFFAOYSA-N
MW365.41 g/mol
LogP4.24
Rot. Bonds3

About N-dibenzofuran-2-yl-4-methylsulfonylbenzamide

N-dibenzofuran-2-yl-4-methylsulfonylbenzamide (PubChem CID 18081219) has the molecular formula C20H15NO4S and a molecular weight of 365.41 g/mol. Its IUPAC name is N-dibenzofuran-2-yl-4-methylsulfonylbenzamide.

Molecular Properties

Compound NameN-dibenzofuran-2-yl-4-methylsulfonylbenzamide
PubChem CID18081219
Molecular FormulaC20H15NO4S
Molecular Weight365.41 g/mol
Exact Mass365.07
IUPAC NameN-dibenzofuran-2-yl-4-methylsulfonylbenzamide
SMILESCS(=O)(=O)c1ccc(C(=O)Nc2ccc3oc4ccccc4c3c2)cc1
InChIInChI=1S/C20H15NO4S/c1-26(23,24)15-9-6-13(7-10-15)20(22)21-14-8-11-19-17(12-14)16-4-2-3-5-18(16)25-19/h2-12H,1H3,(H,21,22)
InChIKeyXYVNLPTVCMYNFJ-UHFFFAOYSA-N
XLogP4.24
TPSA76.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.41
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-dibenzofuran-2-yl-4-[methyl(phenyl)sulfamoyl]benzamide
CID 2110736
N-dibenzofuran-2-yl-4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide
CID 24685944
N-(3,4-dimethylphenyl)dibenzofuran-2-carboxamide
CID 18876126
2-dibenzofuran-2-yloxy-N-(4-methylsulfonylphenyl)acetamide
CID 9455805
N-dibenzofuran-2-yl-3-iodobenzamide
CID 16552353
N-dibenzofuran-3-yl-4-phenylbenzamide
CID 3125062
4-methylsulfonyl-N-(4-phenylphenyl)benzamide
CID 7998967
N-dibenzofuran-3-yl-3,4-dimethylbenzamide
CID 3259661
N-[(2S)-1-(dibenzofuran-2-ylamino)-1-oxopropan-2-yl]benzamide
CID 8002470
N-dibenzofuran-2-yl-5-methyl-1,2-oxazole-3-carboxamide
CID 17430004
N-(4-ethoxyphenyl)dibenzofuran-2-carboxamide
CID 18876152
N-dibenzofuran-2-yl-1,3-benzothiazole-6-carboxamide
CID 16552316

Frequently Asked Questions

What is the IUPAC name of N-dibenzofuran-2-yl-4-methylsulfonylbenzamide?
The IUPAC name of N-dibenzofuran-2-yl-4-methylsulfonylbenzamide (CID 18081219) is N-dibenzofuran-2-yl-4-methylsulfonylbenzamide.
What is the SMILES notation for N-dibenzofuran-2-yl-4-methylsulfonylbenzamide?
The canonical SMILES for N-dibenzofuran-2-yl-4-methylsulfonylbenzamide is CS(=O)(=O)c1ccc(C(=O)Nc2ccc3oc4ccccc4c3c2)cc1.
What is the InChIKey of N-dibenzofuran-2-yl-4-methylsulfonylbenzamide?
The InChIKey is XYVNLPTVCMYNFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15NO4S/c1-26(23,24)15-9-6-13(7-10-15)20(22)21-14-8-11-19-17(12-14)16-4-2-3-5-18(16)25-19/h2-12H,1H3,(H,21,22).
What are the key properties of N-dibenzofuran-2-yl-4-methylsulfonylbenzamide?
N-dibenzofuran-2-yl-4-methylsulfonylbenzamide has a molecular weight of 365.41 g/mol, XLogP of 4.24, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-dibenzofuran-2-yl-4-methylsulfonylbenzamide is sourced from PubChem (CID 18081219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).