N-(2-methoxydibenzofuran-3-yl)-2-(trifluoromethyl)benzenesulfonamide

C20H14F3NO4S — CID 2444978

IUPACN-(2-methoxydibenzofuran-3-yl)-2-(trifluoromethyl)benzenesulfonamide
SMILESCOc1cc2c(cc1NS(=O)(=O)c1ccccc1C(F)(F)F)oc1ccccc12
InChIInChI=1S/C20H14F3NO4S/c1-27-18-10-13-12-6-2-4-8-16(12)28-17(13)11-15(18)24-29(25,26)19-9-5-3-7-14(19)20(21,22)23/h2-11,24H,1H3
InChIKeyRJSCHJRWGJYMJZ-UHFFFAOYSA-N
MW421.40 g/mol
LogP5.41
Rot. Bonds4

About N-(2-methoxydibenzofuran-3-yl)-2-(trifluoromethyl)benzenesulfonamide

N-(2-methoxydibenzofuran-3-yl)-2-(trifluoromethyl)benzenesulfonamide (PubChem CID 2444978) has the molecular formula C20H14F3NO4S and a molecular weight of 421.40 g/mol. Its IUPAC name is N-(2-methoxydibenzofuran-3-yl)-2-(trifluoromethyl)benzenesulfonamide.

Molecular Properties

Compound NameN-(2-methoxydibenzofuran-3-yl)-2-(trifluoromethyl)benzenesulfonamide
PubChem CID2444978
Molecular FormulaC20H14F3NO4S
Molecular Weight421.40 g/mol
Exact Mass421.06
IUPAC NameN-(2-methoxydibenzofuran-3-yl)-2-(trifluoromethyl)benzenesulfonamide
SMILESCOc1cc2c(cc1NS(=O)(=O)c1ccccc1C(F)(F)F)oc1ccccc12
InChIInChI=1S/C20H14F3NO4S/c1-27-18-10-13-12-6-2-4-8-16(12)28-17(13)11-15(18)24-29(25,26)19-9-5-3-7-14(19)20(21,22)23/h2-11,24H,1H3
InChIKeyRJSCHJRWGJYMJZ-UHFFFAOYSA-N
XLogP5.41
TPSA68.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500421.40
LogP ≤ 55.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 2-[(2-methoxydibenzofuran-3-yl)sulfamoyl]benzoate
CID 2457012
2-chloro-N-(2-methoxydibenzofuran-3-yl)-5-(trifluoromethyl)benzenesulfonamide
CID 2457636
4-methoxy-N-(2-methoxydibenzofuran-3-yl)naphthalene-1-sulfonamide
CID 2921082
N-(2,4-dimethoxyphenyl)-2-(trifluoromethyl)benzenesulfonamide
CID 26979627
4-methoxy-3-[[2-(trifluoromethyl)phenyl]sulfonylamino]benzamide
CID 47063072
2-(trifluoromethyl)-N-[4-[[2-(trifluoromethyl)phenyl]sulfonylamino]naphthalen-1-yl]benzenesulfonamide
CID 172801513
N-[bis(2,2,2-trifluoroethoxy)phosphoryl]-2-methoxydibenzofuran-3-amine
CID 3105325
N-(2-methoxydibenzofuran-3-yl)-2-(2,2,2-trifluoroethoxy)acetamide
CID 55488412
N-(2-methoxydibenzofuran-3-yl)-4-[(2-methylphenyl)sulfamoyl]benzamide
CID 26667364
N-(2-methoxydibenzofuran-3-yl)-4-methyl-3-[(4-methylphenyl)sulfamoyl]benzamide
CID 3679313
N-(2-methoxydibenzofuran-3-yl)-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide
CID 4766609
N-(2-chloro-4-methoxyphenyl)-2-(trifluoromethyl)benzenesulfonamide
CID 60597504

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxydibenzofuran-3-yl)-2-(trifluoromethyl)benzenesulfonamide?
The IUPAC name of N-(2-methoxydibenzofuran-3-yl)-2-(trifluoromethyl)benzenesulfonamide (CID 2444978) is N-(2-methoxydibenzofuran-3-yl)-2-(trifluoromethyl)benzenesulfonamide.
What is the SMILES notation for N-(2-methoxydibenzofuran-3-yl)-2-(trifluoromethyl)benzenesulfonamide?
The canonical SMILES for N-(2-methoxydibenzofuran-3-yl)-2-(trifluoromethyl)benzenesulfonamide is COc1cc2c(cc1NS(=O)(=O)c1ccccc1C(F)(F)F)oc1ccccc12.
What is the InChIKey of N-(2-methoxydibenzofuran-3-yl)-2-(trifluoromethyl)benzenesulfonamide?
The InChIKey is RJSCHJRWGJYMJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14F3NO4S/c1-27-18-10-13-12-6-2-4-8-16(12)28-17(13)11-15(18)24-29(25,26)19-9-5-3-7-14(19)20(21,22)23/h2-11,24H,1H3.
What are the key properties of N-(2-methoxydibenzofuran-3-yl)-2-(trifluoromethyl)benzenesulfonamide?
N-(2-methoxydibenzofuran-3-yl)-2-(trifluoromethyl)benzenesulfonamide has a molecular weight of 421.40 g/mol, XLogP of 5.41, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxydibenzofuran-3-yl)-2-(trifluoromethyl)benzenesulfonamide is sourced from PubChem (CID 2444978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).