2-chloro-N-(2-oxo-1,3-dihydroindol-7-yl)thiophene-3-sulfonamide

C12H9ClN2O3S2 — CID 166369413

IUPAC2-chloro-N-(2-oxo-1,3-dihydroindol-7-yl)thiophene-3-sulfonamide
SMILESO=C1Cc2cccc(NS(=O)(=O)c3ccsc3Cl)c2N1
InChIInChI=1S/C12H9ClN2O3S2/c13-12-9(4-5-19-12)20(17,18)15-8-3-1-2-7-6-10(16)14-11(7)8/h1-5,15H,6H2,(H,14,16)
InChIKeyGUDADEKJJAHSFY-UHFFFAOYSA-N
MW328.80 g/mol
LogP2.70
Rot. Bonds3

About 2-chloro-N-(2-oxo-1,3-dihydroindol-7-yl)thiophene-3-sulfonamide

2-chloro-N-(2-oxo-1,3-dihydroindol-7-yl)thiophene-3-sulfonamide (PubChem CID 166369413) has the molecular formula C12H9ClN2O3S2 and a molecular weight of 328.80 g/mol. Its IUPAC name is 2-chloro-N-(2-oxo-1,3-dihydroindol-7-yl)thiophene-3-sulfonamide.

Molecular Properties

Compound Name2-chloro-N-(2-oxo-1,3-dihydroindol-7-yl)thiophene-3-sulfonamide
PubChem CID166369413
Molecular FormulaC12H9ClN2O3S2
Molecular Weight328.80 g/mol
Exact Mass327.97
IUPAC Name2-chloro-N-(2-oxo-1,3-dihydroindol-7-yl)thiophene-3-sulfonamide
SMILESO=C1Cc2cccc(NS(=O)(=O)c3ccsc3Cl)c2N1
InChIInChI=1S/C12H9ClN2O3S2/c13-12-9(4-5-19-12)20(17,18)15-8-3-1-2-7-6-10(16)14-11(7)8/h1-5,15H,6H2,(H,14,16)
InChIKeyGUDADEKJJAHSFY-UHFFFAOYSA-N
XLogP2.70
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.80
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-methoxy-N-(2-oxo-1,3-dihydroindol-7-yl)thiophene-3-sulfonamide
CID 166369492
4-chloro-N-(2-oxo-1,3-dihydroindol-7-yl)benzenesulfonamide
CID 6423275
3-methoxy-N-(2-oxo-1,3-dihydroindol-7-yl)thiophene-2-sulfonamide
CID 166369387
4-fluoro-2-methyl-N-(3-oxo-4H-1,4-benzoxazin-5-yl)benzenesulfonamide
CID 110713237
7-(2-hydroxypropan-2-yl)-1,3-dihydroindol-2-one
CID 117282362
N-(2-chloro-3-pyridinyl)-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 16562517
methyl 3-(5,6,7,8-tetrahydronaphthalen-1-ylsulfamoyl)thiophene-2-carboxylate
CID 3780569
2-[(3-oxo-4H-1,4-benzoxazin-5-yl)sulfonylamino]benzoic acid
CID 166211679
6-chloro-N-(3,4-dimethylphenyl)-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 44634854
1,3-dihydroindol-2-one;sulfamide
CID 160648154
3-[(2-bromophenyl)sulfamoyl]thiophene-2-carboxylic acid
CID 43235689
7-(2-aminoethyl)-1,3-dihydroindol-2-one
CID 82410863

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(2-oxo-1,3-dihydroindol-7-yl)thiophene-3-sulfonamide?
The IUPAC name of 2-chloro-N-(2-oxo-1,3-dihydroindol-7-yl)thiophene-3-sulfonamide (CID 166369413) is 2-chloro-N-(2-oxo-1,3-dihydroindol-7-yl)thiophene-3-sulfonamide.
What is the SMILES notation for 2-chloro-N-(2-oxo-1,3-dihydroindol-7-yl)thiophene-3-sulfonamide?
The canonical SMILES for 2-chloro-N-(2-oxo-1,3-dihydroindol-7-yl)thiophene-3-sulfonamide is O=C1Cc2cccc(NS(=O)(=O)c3ccsc3Cl)c2N1.
What is the InChIKey of 2-chloro-N-(2-oxo-1,3-dihydroindol-7-yl)thiophene-3-sulfonamide?
The InChIKey is GUDADEKJJAHSFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9ClN2O3S2/c13-12-9(4-5-19-12)20(17,18)15-8-3-1-2-7-6-10(16)14-11(7)8/h1-5,15H,6H2,(H,14,16).
What are the key properties of 2-chloro-N-(2-oxo-1,3-dihydroindol-7-yl)thiophene-3-sulfonamide?
2-chloro-N-(2-oxo-1,3-dihydroindol-7-yl)thiophene-3-sulfonamide has a molecular weight of 328.80 g/mol, XLogP of 2.70, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(2-oxo-1,3-dihydroindol-7-yl)thiophene-3-sulfonamide is sourced from PubChem (CID 166369413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).