(2-oxooxolan-3-yl) 4-(thiophen-2-ylsulfonylamino)benzoate

C15H13NO6S2 — CID 3519185

IUPAC(2-oxooxolan-3-yl) 4-(thiophen-2-ylsulfonylamino)benzoate
SMILESO=C(OC1CCOC1=O)c1ccc(NS(=O)(=O)c2cccs2)cc1
InChIInChI=1S/C15H13NO6S2/c17-14(22-12-7-8-21-15(12)18)10-3-5-11(6-4-10)16-24(19,20)13-2-1-9-23-13/h1-6,9,12,16H,7-8H2
InChIKeyGBQLSBAZEMYALU-UHFFFAOYSA-N
MW367.40 g/mol
LogP2.02
Rot. Bonds5

About (2-oxooxolan-3-yl) 4-(thiophen-2-ylsulfonylamino)benzoate

(2-oxooxolan-3-yl) 4-(thiophen-2-ylsulfonylamino)benzoate (PubChem CID 3519185) has the molecular formula C15H13NO6S2 and a molecular weight of 367.40 g/mol. Its IUPAC name is (2-oxooxolan-3-yl) 4-(thiophen-2-ylsulfonylamino)benzoate.

Molecular Properties

Compound Name(2-oxooxolan-3-yl) 4-(thiophen-2-ylsulfonylamino)benzoate
PubChem CID3519185
Molecular FormulaC15H13NO6S2
Molecular Weight367.40 g/mol
Exact Mass367.02
IUPAC Name(2-oxooxolan-3-yl) 4-(thiophen-2-ylsulfonylamino)benzoate
SMILESO=C(OC1CCOC1=O)c1ccc(NS(=O)(=O)c2cccs2)cc1
InChIInChI=1S/C15H13NO6S2/c17-14(22-12-7-8-21-15(12)18)10-3-5-11(6-4-10)16-24(19,20)13-2-1-9-23-13/h1-6,9,12,16H,7-8H2
InChIKeyGBQLSBAZEMYALU-UHFFFAOYSA-N
XLogP2.02
TPSA98.77 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.40
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze (2-oxooxolan-3-yl) 4-(thiophen-2-ylsulfonylamino)benzoate 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

(2,5-dioxopyrrolidin-1-yl) 4-(thiophen-2-ylsulfonylamino)benzoate
CID 86641213
[2-(cyclohexylmethylamino)-2-oxoethyl] 4-(thiophen-2-ylsulfonylamino)benzoate
CID 2347107
[(3S)-2-oxooxolan-3-yl] 4-(1,3-dithiolan-2-yl)benzoate
CID 7744410
4-[2-[4-(thiophen-2-ylsulfonylamino)phenoxy]ethoxy]benzoic acid
CID 68690746
[2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-2-oxoethyl] 4-(thiophen-2-ylsulfonylamino)benzoate
CID 2642115
N-(1-cyclopropylpiperidin-4-yl)-4-(thiophen-2-ylsulfonylamino)benzamide
CID 41269183
N-[4-[4-(oxolan-2-ylmethyl)piperazine-1-carbonyl]phenyl]thiophene-2-sulfonamide
CID 55349251
N-ethoxy-4-(thiophen-2-ylsulfonylamino)benzamide
CID 17470879
methyl 2-[[4-(thiophen-2-ylsulfonylamino)benzoyl]amino]acetate
CID 8840841
[(2R)-1-anilino-1-oxopropan-2-yl] 4-(thiophen-2-ylsulfonylamino)benzoate
CID 97067701
N-[4-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]thiophene-2-sulfonamide
CID 24703518
N-[4-(cyclohexylamino)phenyl]thiophene-2-sulfonamide
CID 112980784

Frequently Asked Questions

What is the IUPAC name of (2-oxooxolan-3-yl) 4-(thiophen-2-ylsulfonylamino)benzoate?
The IUPAC name of (2-oxooxolan-3-yl) 4-(thiophen-2-ylsulfonylamino)benzoate (CID 3519185) is (2-oxooxolan-3-yl) 4-(thiophen-2-ylsulfonylamino)benzoate.
What is the SMILES notation for (2-oxooxolan-3-yl) 4-(thiophen-2-ylsulfonylamino)benzoate?
The canonical SMILES for (2-oxooxolan-3-yl) 4-(thiophen-2-ylsulfonylamino)benzoate is O=C(OC1CCOC1=O)c1ccc(NS(=O)(=O)c2cccs2)cc1.
What is the InChIKey of (2-oxooxolan-3-yl) 4-(thiophen-2-ylsulfonylamino)benzoate?
The InChIKey is GBQLSBAZEMYALU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NO6S2/c17-14(22-12-7-8-21-15(12)18)10-3-5-11(6-4-10)16-24(19,20)13-2-1-9-23-13/h1-6,9,12,16H,7-8H2.
What are the key properties of (2-oxooxolan-3-yl) 4-(thiophen-2-ylsulfonylamino)benzoate?
(2-oxooxolan-3-yl) 4-(thiophen-2-ylsulfonylamino)benzoate has a molecular weight of 367.40 g/mol, XLogP of 2.02, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (2-oxooxolan-3-yl) 4-(thiophen-2-ylsulfonylamino)benzoate is sourced from PubChem (CID 3519185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).