N-[4-(acetylsulfamoyl)phenyl]-3-(2,3-dihydroindol-1-ylsulfonyl)benzamide

C23H21N3O6S2 — CID 2449571

IUPACN-[4-(acetylsulfamoyl)phenyl]-3-(2,3-dihydroindol-1-ylsulfonyl)benzamide
SMILESCC(=O)NS(=O)(=O)c1ccc(NC(=O)c2cccc(S(=O)(=O)N3CCc4ccccc43)c2)cc1
InChIInChI=1S/C23H21N3O6S2/c1-16(27)25-33(29,30)20-11-9-19(10-12-20)24-23(28)18-6-4-7-21(15-18)34(31,32)26-14-13-17-5-2-3-8-22(17)26/h2-12,15H,13-14H2,1H3,(H,24,28)(H,25,27)
InChIKeyDVGXMHFFTNUUSO-UHFFFAOYSA-N
MW499.57 g/mol
LogP2.52
Rot. Bonds6

About N-[4-(acetylsulfamoyl)phenyl]-3-(2,3-dihydroindol-1-ylsulfonyl)benzamide

N-[4-(acetylsulfamoyl)phenyl]-3-(2,3-dihydroindol-1-ylsulfonyl)benzamide (PubChem CID 2449571) has the molecular formula C23H21N3O6S2 and a molecular weight of 499.57 g/mol. Its IUPAC name is N-[4-(acetylsulfamoyl)phenyl]-3-(2,3-dihydroindol-1-ylsulfonyl)benzamide.

Molecular Properties

Compound NameN-[4-(acetylsulfamoyl)phenyl]-3-(2,3-dihydroindol-1-ylsulfonyl)benzamide
PubChem CID2449571
Molecular FormulaC23H21N3O6S2
Molecular Weight499.57 g/mol
Exact Mass499.09
IUPAC NameN-[4-(acetylsulfamoyl)phenyl]-3-(2,3-dihydroindol-1-ylsulfonyl)benzamide
SMILESCC(=O)NS(=O)(=O)c1ccc(NC(=O)c2cccc(S(=O)(=O)N3CCc4ccccc43)c2)cc1
InChIInChI=1S/C23H21N3O6S2/c1-16(27)25-33(29,30)20-11-9-19(10-12-20)24-23(28)18-6-4-7-21(15-18)34(31,32)26-14-13-17-5-2-3-8-22(17)26/h2-12,15H,13-14H2,1H3,(H,24,28)(H,25,27)
InChIKeyDVGXMHFFTNUUSO-UHFFFAOYSA-N
XLogP2.52
TPSA129.72 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500499.57
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-[4-(acetylsulfamoyl)phenyl]-3-(2,3-dihydroindol-1-ylsulfonyl)benzamide 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

1-Methyl-3-Oxo-1,3-Dihydro-Benzo(C)Isothiazole-5-Sulfonic Acid Amide
CID 1387
2,3-dioxo-2,3-dihydro-1H-indole-5-sulfonamide
CID 12142411
N-cyclohexyl-1-ethyl-2-oxo-1,2-dihydrobenzo[cd]indole-6-sulfonamide
CID 1192817
Isatin Sulfonamide 26
CID 9800285
1H-Indole-2,3-dione, 5-(1-azetidinylsulfonyl)-
CID 9903426
N-(2-methoxyethyl)-N-methyl-2,3-dioxo-2,3-dihydro-1H-indole-5-sulfonamide
CID 10851609
N-[(1-Acetylpiperidin-4-Yl)methyl]-1-Ethyl-2-Oxo-1,2-Dihydrobenzo[cd]indole-6-Sulfonamide
CID 90654872
USP30 inhibitor 18
CID 142474792
1H-Benzo[cd]indol-2-one, 1-ethyl-6-(piperazine-1-sulfonyl)-
CID 741724
1-methyl-2-oxo-N-(2-phenylethyl)-2,3-dihydro-1H-indole-5-sulfonamide
CID 1511494
1-Methyl-5-{[(phenylethyl)amino]sulfonyl}indolin-2-one
CID 3163725
N-(2-methylphenyl)-1-propionylindoline-5-sulfonamide
CID 3652315

Frequently Asked Questions

What is the IUPAC name of N-[4-(acetylsulfamoyl)phenyl]-3-(2,3-dihydroindol-1-ylsulfonyl)benzamide?
The IUPAC name of N-[4-(acetylsulfamoyl)phenyl]-3-(2,3-dihydroindol-1-ylsulfonyl)benzamide (CID 2449571) is N-[4-(acetylsulfamoyl)phenyl]-3-(2,3-dihydroindol-1-ylsulfonyl)benzamide.
What is the SMILES notation for N-[4-(acetylsulfamoyl)phenyl]-3-(2,3-dihydroindol-1-ylsulfonyl)benzamide?
The canonical SMILES for N-[4-(acetylsulfamoyl)phenyl]-3-(2,3-dihydroindol-1-ylsulfonyl)benzamide is CC(=O)NS(=O)(=O)c1ccc(NC(=O)c2cccc(S(=O)(=O)N3CCc4ccccc43)c2)cc1.
What is the InChIKey of N-[4-(acetylsulfamoyl)phenyl]-3-(2,3-dihydroindol-1-ylsulfonyl)benzamide?
The InChIKey is DVGXMHFFTNUUSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N3O6S2/c1-16(27)25-33(29,30)20-11-9-19(10-12-20)24-23(28)18-6-4-7-21(15-18)34(31,32)26-14-13-17-5-2-3-8-22(17)26/h2-12,15H,13-14H2,1H3,(H,24,28)(H,25,27).
What are the key properties of N-[4-(acetylsulfamoyl)phenyl]-3-(2,3-dihydroindol-1-ylsulfonyl)benzamide?
N-[4-(acetylsulfamoyl)phenyl]-3-(2,3-dihydroindol-1-ylsulfonyl)benzamide has a molecular weight of 499.57 g/mol, XLogP of 2.52, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(acetylsulfamoyl)phenyl]-3-(2,3-dihydroindol-1-ylsulfonyl)benzamide is sourced from PubChem (CID 2449571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).