[2-oxo-2-(4-sulfamoylanilino)ethyl] 2-thiophen-2-ylacetate

C14H14N2O5S2 — CID 7798869

IUPAC[2-oxo-2-(4-sulfamoylanilino)ethyl] 2-thiophen-2-ylacetate
SMILESNS(=O)(=O)c1ccc(NC(=O)COC(=O)Cc2cccs2)cc1
InChIInChI=1S/C14H14N2O5S2/c15-23(19,20)12-5-3-10(4-6-12)16-13(17)9-21-14(18)8-11-2-1-7-22-11/h1-7H,8-9H2,(H,16,17)(H2,15,19,20)
InChIKeyREUFFVNKBRIMPD-UHFFFAOYSA-N
MW354.41 g/mol
LogP1.12
Rot. Bonds6

About [2-oxo-2-(4-sulfamoylanilino)ethyl] 2-thiophen-2-ylacetate

[2-oxo-2-(4-sulfamoylanilino)ethyl] 2-thiophen-2-ylacetate (PubChem CID 7798869) has the molecular formula C14H14N2O5S2 and a molecular weight of 354.41 g/mol. Its IUPAC name is [2-oxo-2-(4-sulfamoylanilino)ethyl] 2-thiophen-2-ylacetate.

Molecular Properties

Compound Name[2-oxo-2-(4-sulfamoylanilino)ethyl] 2-thiophen-2-ylacetate
PubChem CID7798869
Molecular FormulaC14H14N2O5S2
Molecular Weight354.41 g/mol
Exact Mass354.03
IUPAC Name[2-oxo-2-(4-sulfamoylanilino)ethyl] 2-thiophen-2-ylacetate
SMILESNS(=O)(=O)c1ccc(NC(=O)COC(=O)Cc2cccs2)cc1
InChIInChI=1S/C14H14N2O5S2/c15-23(19,20)12-5-3-10(4-6-12)16-13(17)9-21-14(18)8-11-2-1-7-22-11/h1-7H,8-9H2,(H,16,17)(H2,15,19,20)
InChIKeyREUFFVNKBRIMPD-UHFFFAOYSA-N
XLogP1.12
TPSA115.56 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.41
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze [2-oxo-2-(4-sulfamoylanilino)ethyl] 2-thiophen-2-ylacetate 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-ethylanilino)-2-oxoethyl] 2-thiophen-2-ylacetate
CID 7799264
ethyl 4-[[2-(2-thiophen-2-ylacetyl)oxyacetyl]amino]benzoate
CID 7799286
[2-(3,4-dimethylanilino)-2-oxoethyl] 2-thiophen-2-ylacetate
CID 7799163
[2-oxo-2-(4-phenylmethoxyanilino)ethyl] 2-thiophen-2-ylacetate
CID 7799166
[2-oxo-2-(4-sulfamoylanilino)ethyl] 2-(4-phenylphenyl)acetate
CID 2119188
butyl 4-[[2-(2-thiophen-2-ylacetyl)oxyacetyl]amino]benzoate
CID 7798928
[2-oxo-2-(4-sulfamoylanilino)ethyl] 2-(3-fluorophenyl)acetate
CID 8589912
[2-oxo-2-(4-sulfamoylanilino)ethyl] 2-(2-ethylphenoxy)acetate
CID 2608393
[2-[methyl-[2-(4-methylanilino)-2-oxoethyl]amino]-2-oxoethyl] 2-thiophen-2-ylacetate
CID 7798834
[2-oxo-2-(4-sulfamoylanilino)ethyl] furan-2-carboxylate
CID 2389466
[2-[5-(azepan-1-ylsulfonyl)-2-chloroanilino]-2-oxoethyl] 2-thiophen-2-ylacetate
CID 4856477
[2-(4-bromoanilino)-2-oxoethyl] 4-thiophen-2-ylbutanoate
CID 7962756

Frequently Asked Questions

What is the IUPAC name of [2-oxo-2-(4-sulfamoylanilino)ethyl] 2-thiophen-2-ylacetate?
The IUPAC name of [2-oxo-2-(4-sulfamoylanilino)ethyl] 2-thiophen-2-ylacetate (CID 7798869) is [2-oxo-2-(4-sulfamoylanilino)ethyl] 2-thiophen-2-ylacetate.
What is the SMILES notation for [2-oxo-2-(4-sulfamoylanilino)ethyl] 2-thiophen-2-ylacetate?
The canonical SMILES for [2-oxo-2-(4-sulfamoylanilino)ethyl] 2-thiophen-2-ylacetate is NS(=O)(=O)c1ccc(NC(=O)COC(=O)Cc2cccs2)cc1.
What is the InChIKey of [2-oxo-2-(4-sulfamoylanilino)ethyl] 2-thiophen-2-ylacetate?
The InChIKey is REUFFVNKBRIMPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O5S2/c15-23(19,20)12-5-3-10(4-6-12)16-13(17)9-21-14(18)8-11-2-1-7-22-11/h1-7H,8-9H2,(H,16,17)(H2,15,19,20).
What are the key properties of [2-oxo-2-(4-sulfamoylanilino)ethyl] 2-thiophen-2-ylacetate?
[2-oxo-2-(4-sulfamoylanilino)ethyl] 2-thiophen-2-ylacetate has a molecular weight of 354.41 g/mol, XLogP of 1.12, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-oxo-2-(4-sulfamoylanilino)ethyl] 2-thiophen-2-ylacetate is sourced from PubChem (CID 7798869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).