N-(2-oxo-1H-benzo[cd]indol-6-yl)thiophene-2-sulfonamide

C15H10N2O3S2 — CID 2347707

IUPACN-(2-oxo-1H-benzo[cd]indol-6-yl)thiophene-2-sulfonamide
SMILESO=C1Nc2ccc(NS(=O)(=O)c3cccs3)c3cccc1c23
InChIInChI=1S/C15H10N2O3S2/c18-15-10-4-1-3-9-11(6-7-12(16-15)14(9)10)17-22(19,20)13-5-2-8-21-13/h1-8,17H,(H,16,18)
InChIKeyHJQOFEUTEQOYOK-UHFFFAOYSA-N
MW330.39 g/mol
LogP3.27
Rot. Bonds3

About N-(2-oxo-1H-benzo[cd]indol-6-yl)thiophene-2-sulfonamide

N-(2-oxo-1H-benzo[cd]indol-6-yl)thiophene-2-sulfonamide (PubChem CID 2347707) has the molecular formula C15H10N2O3S2 and a molecular weight of 330.39 g/mol. Its IUPAC name is N-(2-oxo-1H-benzo[cd]indol-6-yl)thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-(2-oxo-1H-benzo[cd]indol-6-yl)thiophene-2-sulfonamide
PubChem CID2347707
Molecular FormulaC15H10N2O3S2
Molecular Weight330.39 g/mol
Exact Mass330.01
IUPAC NameN-(2-oxo-1H-benzo[cd]indol-6-yl)thiophene-2-sulfonamide
SMILESO=C1Nc2ccc(NS(=O)(=O)c3cccs3)c3cccc1c23
InChIInChI=1S/C15H10N2O3S2/c18-15-10-4-1-3-9-11(6-7-12(16-15)14(9)10)17-22(19,20)13-5-2-8-21-13/h1-8,17H,(H,16,18)
InChIKeyHJQOFEUTEQOYOK-UHFFFAOYSA-N
XLogP3.27
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.39
LogP ≤ 53.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-[(4-Benzenesulfonyl-benzyl)-methyl-amino]-1H-benzo[cd]indol-2-one
CID 9845472
6-[[4-(benzenesulfonyl)phenyl]methyl-(methylsulfanylmethyl)amino]-1H-benzo[cd]indol-2-one
CID 15169676
6-[[4-(benzenesulfonyl)phenyl]methyl-ethylamino]-1H-benzo[cd]indol-2-one
CID 15169680
N-((2-Oxo-1,2-dihydrobenzo[cd]indol-6-yl)methyl)thiophene-2-carboxamide
CID 696714
1-(2-thienylcarbonyl)benzo[cd]indol-2(1H)-one
CID 2243529
3-(1-(naphthalen-2-ylmethyl)-2-oxoindolin-7-yl)-N-(thiophen-2-ylsulfonyl)acrylamide
CID 46885431
3-(3-methyl-1-(naphthalen-2-ylmethyl)-2-oxoindolin-7-yl)-N-(thiophen-2-ylsulfonyl)acrylamide
CID 46885652
N-(1-methyl-2-oxobenzo[cd]indol-6-yl)benzenesulfonamide
CID 155563442
6-[[4-(benzenesulfonyl)phenyl]methylamino]-1H-benzo[cd]indol-2-one
CID 15169659
N-[(3Z)-2-oxo-3-(thiophen-2-ylmethylidene)-1H-indol-5-yl]methanesulfonamide
CID 121272820
N-(1-ethyl-2-oxobenzo[cd]indol-6-yl)thiophene-2-sulfonamide
CID 127033172
N-(6-oxo-5H-phenanthridin-2-yl)thiophene-2-sulfonamide
CID 155515498

Frequently Asked Questions

What is the IUPAC name of N-(2-oxo-1H-benzo[cd]indol-6-yl)thiophene-2-sulfonamide?
The IUPAC name of N-(2-oxo-1H-benzo[cd]indol-6-yl)thiophene-2-sulfonamide (CID 2347707) is N-(2-oxo-1H-benzo[cd]indol-6-yl)thiophene-2-sulfonamide.
What is the SMILES notation for N-(2-oxo-1H-benzo[cd]indol-6-yl)thiophene-2-sulfonamide?
The canonical SMILES for N-(2-oxo-1H-benzo[cd]indol-6-yl)thiophene-2-sulfonamide is O=C1Nc2ccc(NS(=O)(=O)c3cccs3)c3cccc1c23.
What is the InChIKey of N-(2-oxo-1H-benzo[cd]indol-6-yl)thiophene-2-sulfonamide?
The InChIKey is HJQOFEUTEQOYOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10N2O3S2/c18-15-10-4-1-3-9-11(6-7-12(16-15)14(9)10)17-22(19,20)13-5-2-8-21-13/h1-8,17H,(H,16,18).
What are the key properties of N-(2-oxo-1H-benzo[cd]indol-6-yl)thiophene-2-sulfonamide?
N-(2-oxo-1H-benzo[cd]indol-6-yl)thiophene-2-sulfonamide has a molecular weight of 330.39 g/mol, XLogP of 3.27, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-oxo-1H-benzo[cd]indol-6-yl)thiophene-2-sulfonamide is sourced from PubChem (CID 2347707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).