[2-(2-methoxyphenyl)-2-oxoethyl] 2-[(2,6-difluorophenyl)sulfonylamino]acetate

C17H15F2NO6S — CID 7956270

IUPAC[2-(2-methoxyphenyl)-2-oxoethyl] 2-[(2,6-difluorophenyl)sulfonylamino]acetate
SMILESCOc1ccccc1C(=O)COC(=O)CNS(=O)(=O)c1c(F)cccc1F
InChIInChI=1S/C17H15F2NO6S/c1-25-15-8-3-2-5-11(15)14(21)10-26-16(22)9-20-27(23,24)17-12(18)6-4-7-13(17)19/h2-8,20H,9-10H2,1H3
InChIKeyZDWYVBOHIHDNDF-UHFFFAOYSA-N
MW399.37 g/mol
LogP1.68
Rot. Bonds8

About [2-(2-methoxyphenyl)-2-oxoethyl] 2-[(2,6-difluorophenyl)sulfonylamino]acetate

[2-(2-methoxyphenyl)-2-oxoethyl] 2-[(2,6-difluorophenyl)sulfonylamino]acetate (PubChem CID 7956270) has the molecular formula C17H15F2NO6S and a molecular weight of 399.37 g/mol. Its IUPAC name is [2-(2-methoxyphenyl)-2-oxoethyl] 2-[(2,6-difluorophenyl)sulfonylamino]acetate.

Molecular Properties

Compound Name[2-(2-methoxyphenyl)-2-oxoethyl] 2-[(2,6-difluorophenyl)sulfonylamino]acetate
PubChem CID7956270
Molecular FormulaC17H15F2NO6S
Molecular Weight399.37 g/mol
Exact Mass399.06
IUPAC Name[2-(2-methoxyphenyl)-2-oxoethyl] 2-[(2,6-difluorophenyl)sulfonylamino]acetate
SMILESCOc1ccccc1C(=O)COC(=O)CNS(=O)(=O)c1c(F)cccc1F
InChIInChI=1S/C17H15F2NO6S/c1-25-15-8-3-2-5-11(15)14(21)10-26-16(22)9-20-27(23,24)17-12(18)6-4-7-13(17)19/h2-8,20H,9-10H2,1H3
InChIKeyZDWYVBOHIHDNDF-UHFFFAOYSA-N
XLogP1.68
TPSA98.77 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.37
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze [2-(2-methoxyphenyl)-2-oxoethyl] 2-[(2,6-difluorophenyl)sulfonylamino]acetate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(2,6-difluorophenoxy)-1-(2-methoxyphenyl)ethanone
CID 78908110
[2-(2-methoxyphenyl)-2-oxoethyl] 2-methoxybenzoate
CID 7811189
1,3-bis(2-methoxyphenyl)propane-1,3-dione
CID 15664665
[2-(2-methoxyphenyl)-2-oxoethyl] 2-[(4-bromobenzoyl)amino]acetate
CID 9364189
[(2R)-1-(4-methoxyphenyl)-1-oxopropan-2-yl] 2-[(2,6-difluorophenyl)sulfonylamino]acetate
CID 7956730
2-(2-fluoroanilino)-1-(2-methoxyphenyl)ethanone
CID 94272670
[2-(2-methoxyphenyl)-2-oxoethyl] 2-(2-hydroxyphenoxy)acetate
CID 23988615
[2-(5-fluoro-2-methoxyphenyl)-2-oxoethyl] 2-[(2-ethoxybenzoyl)amino]acetate
CID 7807725
[2-oxo-2-(3,4,5-trimethoxyphenyl)ethyl] 2-[(2,3,4-trifluorophenyl)sulfonylamino]acetate
CID 16519826
[2-(2,4-dimethoxyphenyl)-2-oxoethyl] 2-(2-fluorophenoxy)acetate
CID 7842228
1-[2-(dimethylsulfamoylamino)acetyl]-2-methoxybenzene
CID 94281798
[2-(2-methoxyphenyl)-2-oxoethyl] 3-(benzylsulfamoyl)benzoate
CID 16520940

Frequently Asked Questions

What is the IUPAC name of [2-(2-methoxyphenyl)-2-oxoethyl] 2-[(2,6-difluorophenyl)sulfonylamino]acetate?
The IUPAC name of [2-(2-methoxyphenyl)-2-oxoethyl] 2-[(2,6-difluorophenyl)sulfonylamino]acetate (CID 7956270) is [2-(2-methoxyphenyl)-2-oxoethyl] 2-[(2,6-difluorophenyl)sulfonylamino]acetate.
What is the SMILES notation for [2-(2-methoxyphenyl)-2-oxoethyl] 2-[(2,6-difluorophenyl)sulfonylamino]acetate?
The canonical SMILES for [2-(2-methoxyphenyl)-2-oxoethyl] 2-[(2,6-difluorophenyl)sulfonylamino]acetate is COc1ccccc1C(=O)COC(=O)CNS(=O)(=O)c1c(F)cccc1F.
What is the InChIKey of [2-(2-methoxyphenyl)-2-oxoethyl] 2-[(2,6-difluorophenyl)sulfonylamino]acetate?
The InChIKey is ZDWYVBOHIHDNDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15F2NO6S/c1-25-15-8-3-2-5-11(15)14(21)10-26-16(22)9-20-27(23,24)17-12(18)6-4-7-13(17)19/h2-8,20H,9-10H2,1H3.
What are the key properties of [2-(2-methoxyphenyl)-2-oxoethyl] 2-[(2,6-difluorophenyl)sulfonylamino]acetate?
[2-(2-methoxyphenyl)-2-oxoethyl] 2-[(2,6-difluorophenyl)sulfonylamino]acetate has a molecular weight of 399.37 g/mol, XLogP of 1.68, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-methoxyphenyl)-2-oxoethyl] 2-[(2,6-difluorophenyl)sulfonylamino]acetate is sourced from PubChem (CID 7956270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).