4-[(4-ethoxy-2-hydroxy-1H-indol-3-yl)diazenyl]benzenesulfonamide

C16H16N4O4S — CID 135434970

IUPAC4-[(4-ethoxy-2-hydroxy-1H-indol-3-yl)diazenyl]benzenesulfonamide
SMILESCCOc1cccc2[nH]c(O)c(/N=N/c3ccc(S(N)(=O)=O)cc3)c12
InChIInChI=1S/C16H16N4O4S/c1-2-24-13-5-3-4-12-14(13)15(16(21)18-12)20-19-10-6-8-11(9-7-10)25(17,22)23/h3-9,18,21H,2H2,1H3,(H2,17,22,23)/b20-19+
InChIKeySQLOMAVYVXFQBS-FMQUCBEESA-N
MW360.40 g/mol
LogP3.34
Rot. Bonds5

About 4-[(4-ethoxy-2-hydroxy-1H-indol-3-yl)diazenyl]benzenesulfonamide

4-[(4-ethoxy-2-hydroxy-1H-indol-3-yl)diazenyl]benzenesulfonamide (PubChem CID 135434970) has the molecular formula C16H16N4O4S and a molecular weight of 360.40 g/mol. Its IUPAC name is 4-[(4-ethoxy-2-hydroxy-1H-indol-3-yl)diazenyl]benzenesulfonamide.

Molecular Properties

Compound Name4-[(4-ethoxy-2-hydroxy-1H-indol-3-yl)diazenyl]benzenesulfonamide
PubChem CID135434970
Molecular FormulaC16H16N4O4S
Molecular Weight360.40 g/mol
Exact Mass360.09
IUPAC Name4-[(4-ethoxy-2-hydroxy-1H-indol-3-yl)diazenyl]benzenesulfonamide
SMILESCCOc1cccc2[nH]c(O)c(/N=N/c3ccc(S(N)(=O)=O)cc3)c12
InChIInChI=1S/C16H16N4O4S/c1-2-24-13-5-3-4-12-14(13)15(16(21)18-12)20-19-10-6-8-11(9-7-10)25(17,22)23/h3-9,18,21H,2H2,1H3,(H2,17,22,23)/b20-19+
InChIKeySQLOMAVYVXFQBS-FMQUCBEESA-N
XLogP3.34
TPSA130.13 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.40
LogP ≤ 53.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

Analyze 4-[(4-ethoxy-2-hydroxy-1H-indol-3-yl)diazenyl]benzenesulfonamide 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

Oxindole-Based Inhibitor 44
CID 135405216
Oxindole-Based Inhibitor 17
CID 135434964
Oxindole-Based Inhibitor 31
CID 135434971
Oxindole-Based Inhibitor 32
CID 135434972
Oxindole-Based Inhibitor 45
CID 135434980
Glycine, N-[(4-ethoxyphenyl)sulfonyl]-N-(4-methylphenyl)-, (1,2-dihydro-2-oxo-3H-indol-3-ylidene)hydrazide (9CI)
CID 1103817
Oxindole-Based Inhibitor 69
CID 135434996
2-(N-(4-ethoxyphenyl)sulfonyl-4-methylanilino)-N-[(2-hydroxy-1H-indol-3-yl)imino]propanamide
CID 135399794
N-[(2-hydroxy-1H-indol-3-yl)imino]-2-(N-(4-methoxyphenyl)sulfonyl-4-methylanilino)acetamide
CID 135446053
4-Ethoxy-N-({N'-[(3Z)-2-oxo-2,3-dihydro-1H-indol-3-ylidene]hydrazinecarbonyl}methyl)-N-phenylbenzene-1-sulfonamide
CID 135461089
N-[(2-hydroxy-1H-indol-3-yl)imino]-2-(4-methyl-N-(4-propoxyphenyl)sulfonylanilino)acetamide
CID 135461099
4-methoxy-N'-[(3E)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]benzenesulfonohydrazide
CID 5103403

Frequently Asked Questions

What is the IUPAC name of 4-[(4-ethoxy-2-hydroxy-1H-indol-3-yl)diazenyl]benzenesulfonamide?
The IUPAC name of 4-[(4-ethoxy-2-hydroxy-1H-indol-3-yl)diazenyl]benzenesulfonamide (CID 135434970) is 4-[(4-ethoxy-2-hydroxy-1H-indol-3-yl)diazenyl]benzenesulfonamide.
What is the SMILES notation for 4-[(4-ethoxy-2-hydroxy-1H-indol-3-yl)diazenyl]benzenesulfonamide?
The canonical SMILES for 4-[(4-ethoxy-2-hydroxy-1H-indol-3-yl)diazenyl]benzenesulfonamide is CCOc1cccc2[nH]c(O)c(/N=N/c3ccc(S(N)(=O)=O)cc3)c12.
What is the InChIKey of 4-[(4-ethoxy-2-hydroxy-1H-indol-3-yl)diazenyl]benzenesulfonamide?
The InChIKey is SQLOMAVYVXFQBS-FMQUCBEESA-N. The full InChI is InChI=1S/C16H16N4O4S/c1-2-24-13-5-3-4-12-14(13)15(16(21)18-12)20-19-10-6-8-11(9-7-10)25(17,22)23/h3-9,18,21H,2H2,1H3,(H2,17,22,23)/b20-19+.
What are the key properties of 4-[(4-ethoxy-2-hydroxy-1H-indol-3-yl)diazenyl]benzenesulfonamide?
4-[(4-ethoxy-2-hydroxy-1H-indol-3-yl)diazenyl]benzenesulfonamide has a molecular weight of 360.40 g/mol, XLogP of 3.34, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-ethoxy-2-hydroxy-1H-indol-3-yl)diazenyl]benzenesulfonamide is sourced from PubChem (CID 135434970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).