N-(2,4-difluorophenyl)sulfonyl-N-(4-methoxyphenyl)benzamide

C20H15F2NO4S — CID 126615373

IUPACN-(2,4-difluorophenyl)sulfonyl-N-(4-methoxyphenyl)benzamide
SMILESCOc1ccc(N(C(=O)c2ccccc2)S(=O)(=O)c2ccc(F)cc2F)cc1
InChIInChI=1S/C20H15F2NO4S/c1-27-17-10-8-16(9-11-17)23(20(24)14-5-3-2-4-6-14)28(25,26)19-12-7-15(21)13-18(19)22/h2-13H,1H3
InChIKeyZJIRSOPKOBQVFO-UHFFFAOYSA-N
MW403.41 g/mol
LogP4.01
Rot. Bonds5

About N-(2,4-difluorophenyl)sulfonyl-N-(4-methoxyphenyl)benzamide

N-(2,4-difluorophenyl)sulfonyl-N-(4-methoxyphenyl)benzamide (PubChem CID 126615373) has the molecular formula C20H15F2NO4S and a molecular weight of 403.41 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)sulfonyl-N-(4-methoxyphenyl)benzamide.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)sulfonyl-N-(4-methoxyphenyl)benzamide
PubChem CID126615373
Molecular FormulaC20H15F2NO4S
Molecular Weight403.41 g/mol
Exact Mass403.07
IUPAC NameN-(2,4-difluorophenyl)sulfonyl-N-(4-methoxyphenyl)benzamide
SMILESCOc1ccc(N(C(=O)c2ccccc2)S(=O)(=O)c2ccc(F)cc2F)cc1
InChIInChI=1S/C20H15F2NO4S/c1-27-17-10-8-16(9-11-17)23(20(24)14-5-3-2-4-6-14)28(25,26)19-12-7-15(21)13-18(19)22/h2-13H,1H3
InChIKeyZJIRSOPKOBQVFO-UHFFFAOYSA-N
XLogP4.01
TPSA63.68 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.41
LogP ≤ 54.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-bromo-2-methoxyphenyl)sulfonyl-N-(4-methoxyphenyl)benzamide;N-(2,4-difluorophenyl)sulfonyl-N-(4-methoxyphenyl)benzamide;N-(3-fluorophenyl)sulfonyl-N-(4-methoxyphenyl)benzamide
CID 162220980
N-benzyl-2,4-difluoro-N-(4-methoxyphenyl)benzenesulfonamide
CID 32681303
2-(N-(2,4-difluorophenyl)sulfonyl-4-methoxyanilino)-N-phenylacetamide
CID 4787927
N-(4-chlorophenyl)sulfonyl-3-methoxy-N-(4-methoxyphenyl)benzamide
CID 19211456
2,3,5-trifluoro-N-(2-formyl-5-methoxyphenyl)sulfonyl-N-(4-methoxyphenyl)benzamide
CID 155346544
4-methoxy-N-(4-methoxyphenyl)-N-thiophen-2-ylsulfonylbenzamide
CID 993467
N-(benzenesulfonyl)-N-(4-methoxyphenyl)-3,5-dinitrobenzamide
CID 19210794
N-(benzenesulfonyl)-2-methoxy-N-(4-methoxyphenyl)benzamide
CID 19204610
2-fluoro-N-(4-methoxyphenyl)-N-methylbenzenesulfonamide
CID 60643138
N-(4-fluoro-2-methylphenyl)sulfonyl-N-(2-oxo-1,3-benzoxathiol-5-yl)benzamide
CID 3629326
N-benzyl-4-fluoro-N-(4-methoxyphenyl)benzamide
CID 3724237
N-(4-fluorophenyl)-N-[3-[(4-methoxyphenyl)sulfonylamino]propyl]benzamide
CID 42726365

Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)sulfonyl-N-(4-methoxyphenyl)benzamide?
The IUPAC name of N-(2,4-difluorophenyl)sulfonyl-N-(4-methoxyphenyl)benzamide (CID 126615373) is N-(2,4-difluorophenyl)sulfonyl-N-(4-methoxyphenyl)benzamide.
What is the SMILES notation for N-(2,4-difluorophenyl)sulfonyl-N-(4-methoxyphenyl)benzamide?
The canonical SMILES for N-(2,4-difluorophenyl)sulfonyl-N-(4-methoxyphenyl)benzamide is COc1ccc(N(C(=O)c2ccccc2)S(=O)(=O)c2ccc(F)cc2F)cc1.
What is the InChIKey of N-(2,4-difluorophenyl)sulfonyl-N-(4-methoxyphenyl)benzamide?
The InChIKey is ZJIRSOPKOBQVFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15F2NO4S/c1-27-17-10-8-16(9-11-17)23(20(24)14-5-3-2-4-6-14)28(25,26)19-12-7-15(21)13-18(19)22/h2-13H,1H3.
What are the key properties of N-(2,4-difluorophenyl)sulfonyl-N-(4-methoxyphenyl)benzamide?
N-(2,4-difluorophenyl)sulfonyl-N-(4-methoxyphenyl)benzamide has a molecular weight of 403.41 g/mol, XLogP of 4.01, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluorophenyl)sulfonyl-N-(4-methoxyphenyl)benzamide is sourced from PubChem (CID 126615373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).