2-[2-[2-[4-(naphthalen-2-ylsulfonylamino)phenoxy]ethoxy]phenyl]acetic acid

C26H23NO6S — CID 11655897

IUPAC2-[2-[2-[4-(naphthalen-2-ylsulfonylamino)phenoxy]ethoxy]phenyl]acetic acid
SMILESO=C(O)Cc1ccccc1OCCOc1ccc(NS(=O)(=O)c2ccc3ccccc3c2)cc1
InChIInChI=1S/C26H23NO6S/c28-26(29)18-21-7-3-4-8-25(21)33-16-15-32-23-12-10-22(11-13-23)27-34(30,31)24-14-9-19-5-1-2-6-20(19)17-24/h1-14,17,27H,15-16,18H2,(H,28,29)
InChIKeyWTWPDLKKLJSPCJ-UHFFFAOYSA-N
MW477.54 g/mol
LogP4.73
Rot. Bonds10

About 2-[2-[2-[4-(naphthalen-2-ylsulfonylamino)phenoxy]ethoxy]phenyl]acetic acid

2-[2-[2-[4-(naphthalen-2-ylsulfonylamino)phenoxy]ethoxy]phenyl]acetic acid (PubChem CID 11655897) has the molecular formula C26H23NO6S and a molecular weight of 477.54 g/mol. Its IUPAC name is 2-[2-[2-[4-(naphthalen-2-ylsulfonylamino)phenoxy]ethoxy]phenyl]acetic acid.

Molecular Properties

Compound Name2-[2-[2-[4-(naphthalen-2-ylsulfonylamino)phenoxy]ethoxy]phenyl]acetic acid
PubChem CID11655897
Molecular FormulaC26H23NO6S
Molecular Weight477.54 g/mol
Exact Mass477.12
IUPAC Name2-[2-[2-[4-(naphthalen-2-ylsulfonylamino)phenoxy]ethoxy]phenyl]acetic acid
SMILESO=C(O)Cc1ccccc1OCCOc1ccc(NS(=O)(=O)c2ccc3ccccc3c2)cc1
InChIInChI=1S/C26H23NO6S/c28-26(29)18-21-7-3-4-8-25(21)33-16-15-32-23-12-10-22(11-13-23)27-34(30,31)24-14-9-19-5-1-2-6-20(19)17-24/h1-14,17,27H,15-16,18H2,(H,28,29)
InChIKeyWTWPDLKKLJSPCJ-UHFFFAOYSA-N
XLogP4.73
TPSA101.93 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500477.54
LogP ≤ 54.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2-[2-[2-[4-(naphthalen-2-ylsulfonylamino)phenoxy]ethoxy]phenyl]acetic acid 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-[2-[4-[(4-phenylphenyl)sulfonylamino]phenoxy]ethoxy]phenyl]acetic acid
CID 11540637
2-[2-[2-[4-[(4-chlorophenyl)sulfonylamino]phenoxy]ethoxy]phenyl]acetic acid
CID 68687829
2-[2-[2-[4-[(4-propan-2-ylphenyl)sulfonylamino]phenoxy]ethoxy]phenyl]acetic acid
CID 68689364
2-[4-(naphthalen-2-ylsulfonylamino)phenyl]acetic acid
CID 2412067
3-[2-[2-[4-[(2-acetamido-4-methyl-1,3-thiazol-5-yl)sulfonylamino]phenoxy]ethoxy]phenyl]propanoic acid;3-[2-[2-[4-(naphthalen-2-ylsulfonylamino)phenoxy]ethoxy]phenyl]propanoic acid
CID 159389218
2-[2-[4-[(4-methoxy-2,3,6-trimethylphenyl)sulfonylamino]phenoxy]ethoxy]benzoic acid;2-[2-[4-(naphthalen-2-ylsulfonylamino)phenoxy]ethoxy]benzoic acid
CID 158251988
2-[2-[2-[4-[(2-methoxycarbonylphenyl)sulfonylamino]phenoxy]ethoxy]phenyl]acetic acid;2-[2-[2-[4-[[4-(2-methylbutan-2-yl)phenyl]sulfonylamino]phenoxy]ethoxy]phenyl]acetic acid
CID 158268185
[2-[2-[2-[4-[(4-chlorophenyl)sulfonylamino]phenoxy]ethoxy]phenyl]acetyl] 2-[2-[2-[4-[(4-acetamidophenyl)sulfonylamino]phenoxy]ethoxy]phenyl]acetate
CID 90904973
3-[2-[2-[4-[(2-fluorophenyl)sulfonylamino]phenoxy]ethoxy]phenyl]propanoic acid
CID 68690108
2-[2-[4-[(3-methoxyphenyl)sulfonylamino]phenoxy]ethoxy]benzoic acid
CID 68688879
4-ethoxy-N-naphthalen-2-ylbenzenesulfonamide
CID 7938656
N-[4-(2-methoxyethoxy)phenyl]benzenesulfonamide
CID 39874629

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-[4-(naphthalen-2-ylsulfonylamino)phenoxy]ethoxy]phenyl]acetic acid?
The IUPAC name of 2-[2-[2-[4-(naphthalen-2-ylsulfonylamino)phenoxy]ethoxy]phenyl]acetic acid (CID 11655897) is 2-[2-[2-[4-(naphthalen-2-ylsulfonylamino)phenoxy]ethoxy]phenyl]acetic acid.
What is the SMILES notation for 2-[2-[2-[4-(naphthalen-2-ylsulfonylamino)phenoxy]ethoxy]phenyl]acetic acid?
The canonical SMILES for 2-[2-[2-[4-(naphthalen-2-ylsulfonylamino)phenoxy]ethoxy]phenyl]acetic acid is O=C(O)Cc1ccccc1OCCOc1ccc(NS(=O)(=O)c2ccc3ccccc3c2)cc1.
What is the InChIKey of 2-[2-[2-[4-(naphthalen-2-ylsulfonylamino)phenoxy]ethoxy]phenyl]acetic acid?
The InChIKey is WTWPDLKKLJSPCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H23NO6S/c28-26(29)18-21-7-3-4-8-25(21)33-16-15-32-23-12-10-22(11-13-23)27-34(30,31)24-14-9-19-5-1-2-6-20(19)17-24/h1-14,17,27H,15-16,18H2,(H,28,29).
What are the key properties of 2-[2-[2-[4-(naphthalen-2-ylsulfonylamino)phenoxy]ethoxy]phenyl]acetic acid?
2-[2-[2-[4-(naphthalen-2-ylsulfonylamino)phenoxy]ethoxy]phenyl]acetic acid has a molecular weight of 477.54 g/mol, XLogP of 4.73, 10 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-[4-(naphthalen-2-ylsulfonylamino)phenoxy]ethoxy]phenyl]acetic acid is sourced from PubChem (CID 11655897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).