2-[(4-bromophenyl)sulfonylamino]-N-[(2-hydroxy-1H-indol-3-yl)imino]acetamide

C16H13BrN4O4S — CID 135957644

IUPAC2-[(4-bromophenyl)sulfonylamino]-N-[(2-hydroxy-1H-indol-3-yl)imino]acetamide
SMILESO=C(CNS(=O)(=O)c1ccc(Br)cc1)/N=N/c1c(O)[nH]c2ccccc12
InChIInChI=1S/C16H13BrN4O4S/c17-10-5-7-11(8-6-10)26(24,25)18-9-14(22)20-21-15-12-3-1-2-4-13(12)19-16(15)23/h1-8,18-19,23H,9H2/b21-20+
InChIKeyCGSASAAPPOFQMR-QZQOTICOSA-N
MW437.28 g/mol
LogP3.22
Rot. Bonds5

About 2-[(4-bromophenyl)sulfonylamino]-N-[(2-hydroxy-1H-indol-3-yl)imino]acetamide

2-[(4-bromophenyl)sulfonylamino]-N-[(2-hydroxy-1H-indol-3-yl)imino]acetamide (PubChem CID 135957644) has the molecular formula C16H13BrN4O4S and a molecular weight of 437.28 g/mol. Its IUPAC name is 2-[(4-bromophenyl)sulfonylamino]-N-[(2-hydroxy-1H-indol-3-yl)imino]acetamide.

Molecular Properties

Compound Name2-[(4-bromophenyl)sulfonylamino]-N-[(2-hydroxy-1H-indol-3-yl)imino]acetamide
PubChem CID135957644
Molecular FormulaC16H13BrN4O4S
Molecular Weight437.28 g/mol
Exact Mass435.98
IUPAC Name2-[(4-bromophenyl)sulfonylamino]-N-[(2-hydroxy-1H-indol-3-yl)imino]acetamide
SMILESO=C(CNS(=O)(=O)c1ccc(Br)cc1)/N=N/c1c(O)[nH]c2ccccc12
InChIInChI=1S/C16H13BrN4O4S/c17-10-5-7-11(8-6-10)26(24,25)18-9-14(22)20-21-15-12-3-1-2-4-13(12)19-16(15)23/h1-8,18-19,23H,9H2/b21-20+
InChIKeyCGSASAAPPOFQMR-QZQOTICOSA-N
XLogP3.22
TPSA123.98 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500437.28
LogP ≤ 53.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 2-[(4-bromophenyl)sulfonylamino]-N-[(2-hydroxy-1H-indol-3-yl)imino]acetamide 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-(4-bromoanilino)-N-[(2-hydroxy-1H-indol-3-yl)imino]acetamide
CID 1494119
2-[N-(benzenesulfonyl)-4-bromoanilino]-N-[(2-hydroxy-1H-indol-3-yl)imino]acetamide
CID 137077764
4-bromo-N-[(2-hydroxy-1H-indol-3-yl)imino]benzenesulfonamide
CID 1380360
2-ethoxy-N-[(2-hydroxy-1H-indol-3-yl)imino]acetamide
CID 135802167
N-[3-[(2-hydroxy-1H-indol-3-yl)diazenyl]-3-oxopropyl]benzamide
CID 4997686
2-[N-(benzenesulfonyl)-3-bromoanilino]-N-[(5-bromo-2-hydroxy-1H-indol-3-yl)imino]acetamide
CID 137083434
2-(2-fluoro-N-methylsulfonylanilino)-N-[(2-hydroxy-1H-indol-3-yl)imino]acetamide
CID 4207939
N-[(2-hydroxy-1H-indol-3-yl)imino]-2-pyrrolidin-1-ylacetamide
CID 3070816
3-bromo-N-[(2-hydroxy-1H-indol-3-yl)imino]benzamide
CID 749764
4-hydroxy-N-[(2-hydroxy-1H-indol-3-yl)imino]pentanamide
CID 3134459
2-[benzenesulfonyl(pyridin-3-yl)amino]-N-[(2-hydroxy-1H-indol-3-yl)imino]acetamide
CID 135645724
N'-[(2-hydroxy-1H-indol-3-yl)imino]-N-[(E)-(2-hydroxyphenyl)methylideneamino]propanediamide
CID 135981199

Frequently Asked Questions

What is the IUPAC name of 2-[(4-bromophenyl)sulfonylamino]-N-[(2-hydroxy-1H-indol-3-yl)imino]acetamide?
The IUPAC name of 2-[(4-bromophenyl)sulfonylamino]-N-[(2-hydroxy-1H-indol-3-yl)imino]acetamide (CID 135957644) is 2-[(4-bromophenyl)sulfonylamino]-N-[(2-hydroxy-1H-indol-3-yl)imino]acetamide.
What is the SMILES notation for 2-[(4-bromophenyl)sulfonylamino]-N-[(2-hydroxy-1H-indol-3-yl)imino]acetamide?
The canonical SMILES for 2-[(4-bromophenyl)sulfonylamino]-N-[(2-hydroxy-1H-indol-3-yl)imino]acetamide is O=C(CNS(=O)(=O)c1ccc(Br)cc1)/N=N/c1c(O)[nH]c2ccccc12.
What is the InChIKey of 2-[(4-bromophenyl)sulfonylamino]-N-[(2-hydroxy-1H-indol-3-yl)imino]acetamide?
The InChIKey is CGSASAAPPOFQMR-QZQOTICOSA-N. The full InChI is InChI=1S/C16H13BrN4O4S/c17-10-5-7-11(8-6-10)26(24,25)18-9-14(22)20-21-15-12-3-1-2-4-13(12)19-16(15)23/h1-8,18-19,23H,9H2/b21-20+.
What are the key properties of 2-[(4-bromophenyl)sulfonylamino]-N-[(2-hydroxy-1H-indol-3-yl)imino]acetamide?
2-[(4-bromophenyl)sulfonylamino]-N-[(2-hydroxy-1H-indol-3-yl)imino]acetamide has a molecular weight of 437.28 g/mol, XLogP of 3.22, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-bromophenyl)sulfonylamino]-N-[(2-hydroxy-1H-indol-3-yl)imino]acetamide is sourced from PubChem (CID 135957644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).