1-(4-ethoxyphenyl)sulfonyl-4-methoxybenzene

C15H16O4S — CID 59120135

IUPAC1-(4-ethoxyphenyl)sulfonyl-4-methoxybenzene
SMILESCCOc1ccc(S(=O)(=O)c2ccc(OC)cc2)cc1
InChIInChI=1S/C15H16O4S/c1-3-19-13-6-10-15(11-7-13)20(16,17)14-8-4-12(18-2)5-9-14/h4-11H,3H2,1-2H3
InChIKeyZIOMAOFQZNQLOD-UHFFFAOYSA-N
MW292.36 g/mol
LogP2.93
Rot. Bonds5

About 1-(4-ethoxyphenyl)sulfonyl-4-methoxybenzene

1-(4-ethoxyphenyl)sulfonyl-4-methoxybenzene (PubChem CID 59120135) has the molecular formula C15H16O4S and a molecular weight of 292.36 g/mol. Its IUPAC name is 1-(4-ethoxyphenyl)sulfonyl-4-methoxybenzene.

Molecular Properties

Compound Name1-(4-ethoxyphenyl)sulfonyl-4-methoxybenzene
PubChem CID59120135
Molecular FormulaC15H16O4S
Molecular Weight292.36 g/mol
Exact Mass292.08
IUPAC Name1-(4-ethoxyphenyl)sulfonyl-4-methoxybenzene
SMILESCCOc1ccc(S(=O)(=O)c2ccc(OC)cc2)cc1
InChIInChI=1S/C15H16O4S/c1-3-19-13-6-10-15(11-7-13)20(16,17)14-8-4-12(18-2)5-9-14/h4-11H,3H2,1-2H3
InChIKeyZIOMAOFQZNQLOD-UHFFFAOYSA-N
XLogP2.93
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.36
LogP ≤ 52.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-(4-ethoxyphenyl)sulfonyl-4-methoxybenzene 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

1-methoxy-4-[4-(4-methoxyphenyl)sulfonylphenyl]sulfonylbenzene
CID 71186281
1-(benzenesulfonyl)-4-ethoxybenzene
CID 12563171
4-ethoxy-N-(4-methoxyphenyl)benzenesulfonamide
CID 4202178
1-ethoxy-4-ethylsulfonylbenzene
CID 12846221
5-(4-ethoxyphenyl)sulfonylpyrimidin-2-amine
CID 95483159
N-[2-(4-ethoxyphenoxy)ethyl]-4-methoxybenzenesulfonamide
CID 40753909
4-[4-[7-[4-(4-ethoxyphenyl)sulfonylphenoxy]heptoxy]phenyl]sulfonylphenol
CID 139963527
4-[4-[10-[4-(4-methoxyphenyl)sulfonylphenoxy]decoxy]phenyl]sulfonylphenol
CID 139963560
N-[4-(4-ethoxyanilino)phenyl]-4-methoxybenzenesulfonamide
CID 112987708
4-ethoxybenzenesulfonic acid
CID 7013020
[4-(4-methoxyphenyl)sulfonylphenyl] hypoiodite
CID 118689702
[4-(4-methoxyphenyl)sulfonylphenyl]methanol
CID 70863002

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethoxyphenyl)sulfonyl-4-methoxybenzene?
The IUPAC name of 1-(4-ethoxyphenyl)sulfonyl-4-methoxybenzene (CID 59120135) is 1-(4-ethoxyphenyl)sulfonyl-4-methoxybenzene.
What is the SMILES notation for 1-(4-ethoxyphenyl)sulfonyl-4-methoxybenzene?
The canonical SMILES for 1-(4-ethoxyphenyl)sulfonyl-4-methoxybenzene is CCOc1ccc(S(=O)(=O)c2ccc(OC)cc2)cc1.
What is the InChIKey of 1-(4-ethoxyphenyl)sulfonyl-4-methoxybenzene?
The InChIKey is ZIOMAOFQZNQLOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16O4S/c1-3-19-13-6-10-15(11-7-13)20(16,17)14-8-4-12(18-2)5-9-14/h4-11H,3H2,1-2H3.
What are the key properties of 1-(4-ethoxyphenyl)sulfonyl-4-methoxybenzene?
1-(4-ethoxyphenyl)sulfonyl-4-methoxybenzene has a molecular weight of 292.36 g/mol, XLogP of 2.93, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethoxyphenyl)sulfonyl-4-methoxybenzene is sourced from PubChem (CID 59120135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).