N-(1-acetyl-2,3-dihydroindol-6-yl)-2-oxo-3H-1,3-benzoxazole-6-sulfonamide

C17H15N3O5S — CID 110288193

IUPACN-(1-acetyl-2,3-dihydroindol-6-yl)-2-oxo-3H-1,3-benzoxazole-6-sulfonamide
SMILESCC(=O)N1CCc2ccc(NS(=O)(=O)c3ccc4[nH]c(=O)oc4c3)cc21
InChIInChI=1S/C17H15N3O5S/c1-10(21)20-7-6-11-2-3-12(8-15(11)20)19-26(23,24)13-4-5-14-16(9-13)25-17(22)18-14/h2-5,8-9,19H,6-7H2,1H3,(H,18,22)
InChIKeyJSTISFWDKUONSJ-UHFFFAOYSA-N
MW373.39 g/mol
LogP1.83
Rot. Bonds3

About N-(1-acetyl-2,3-dihydroindol-6-yl)-2-oxo-3H-1,3-benzoxazole-6-sulfonamide

N-(1-acetyl-2,3-dihydroindol-6-yl)-2-oxo-3H-1,3-benzoxazole-6-sulfonamide (PubChem CID 110288193) has the molecular formula C17H15N3O5S and a molecular weight of 373.39 g/mol. Its IUPAC name is N-(1-acetyl-2,3-dihydroindol-6-yl)-2-oxo-3H-1,3-benzoxazole-6-sulfonamide.

Molecular Properties

Compound NameN-(1-acetyl-2,3-dihydroindol-6-yl)-2-oxo-3H-1,3-benzoxazole-6-sulfonamide
PubChem CID110288193
Molecular FormulaC17H15N3O5S
Molecular Weight373.39 g/mol
Exact Mass373.07
IUPAC NameN-(1-acetyl-2,3-dihydroindol-6-yl)-2-oxo-3H-1,3-benzoxazole-6-sulfonamide
SMILESCC(=O)N1CCc2ccc(NS(=O)(=O)c3ccc4[nH]c(=O)oc4c3)cc21
InChIInChI=1S/C17H15N3O5S/c1-10(21)20-7-6-11-2-3-12(8-15(11)20)19-26(23,24)13-4-5-14-16(9-13)25-17(22)18-14/h2-5,8-9,19H,6-7H2,1H3,(H,18,22)
InChIKeyJSTISFWDKUONSJ-UHFFFAOYSA-N
XLogP1.83
TPSA112.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.39
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-(1-acetyl-2,3-dihydroindol-6-yl)-2-oxo-3H-1,3-benzoxazole-6-sulfonamide 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

methyl N-[4-[(1-acetyl-2,3-dihydroindol-6-yl)sulfamoyl]phenyl]carbamate
CID 91624470
N-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-2-oxo-3H-1,3-benzoxazole-6-sulfonamide
CID 110370794
1-methyl-2-oxo-N-(2-oxo-3H-1,3-benzoxazol-6-yl)-3H-indole-5-sulfonamide
CID 110350539
N-methyl-4-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonylamino]benzamide
CID 134055659
N-(1-acetyl-3,4-dihydro-2H-quinolin-7-yl)-3-fluorobenzenesulfonamide
CID 7517556
1-acetyl-N-(2-tert-butyl-3H-benzimidazol-5-yl)-2,3-dihydroindole-5-sulfonamide
CID 78820343
N-(4-aminophenyl)-2-oxo-3H-1,3-benzoxazole-6-sulfonamide
CID 82104270
1-acetyl-N-(4-methyl-3-oxo-1,4-benzoxazin-6-yl)-2,3-dihydroindole-5-sulfonamide
CID 46970401
1-acetyl-N-(1-propylindol-5-yl)-2,3-dihydroindole-6-sulfonamide
CID 126776307
1-acetyl-N-(4,6-dimethylpyrimidin-2-yl)-2,3-dihydroindole-6-sulfonamide
CID 122141660
1-[6-(propylsulfamoylamino)-2,3-dihydroindol-1-yl]ethanone
CID 110627257
N-[3-[(1-acetyl-2,3-dihydroindol-5-yl)sulfonylamino]phenyl]acetamide
CID 40687880

Frequently Asked Questions

What is the IUPAC name of N-(1-acetyl-2,3-dihydroindol-6-yl)-2-oxo-3H-1,3-benzoxazole-6-sulfonamide?
The IUPAC name of N-(1-acetyl-2,3-dihydroindol-6-yl)-2-oxo-3H-1,3-benzoxazole-6-sulfonamide (CID 110288193) is N-(1-acetyl-2,3-dihydroindol-6-yl)-2-oxo-3H-1,3-benzoxazole-6-sulfonamide.
What is the SMILES notation for N-(1-acetyl-2,3-dihydroindol-6-yl)-2-oxo-3H-1,3-benzoxazole-6-sulfonamide?
The canonical SMILES for N-(1-acetyl-2,3-dihydroindol-6-yl)-2-oxo-3H-1,3-benzoxazole-6-sulfonamide is CC(=O)N1CCc2ccc(NS(=O)(=O)c3ccc4[nH]c(=O)oc4c3)cc21.
What is the InChIKey of N-(1-acetyl-2,3-dihydroindol-6-yl)-2-oxo-3H-1,3-benzoxazole-6-sulfonamide?
The InChIKey is JSTISFWDKUONSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O5S/c1-10(21)20-7-6-11-2-3-12(8-15(11)20)19-26(23,24)13-4-5-14-16(9-13)25-17(22)18-14/h2-5,8-9,19H,6-7H2,1H3,(H,18,22).
What are the key properties of N-(1-acetyl-2,3-dihydroindol-6-yl)-2-oxo-3H-1,3-benzoxazole-6-sulfonamide?
N-(1-acetyl-2,3-dihydroindol-6-yl)-2-oxo-3H-1,3-benzoxazole-6-sulfonamide has a molecular weight of 373.39 g/mol, XLogP of 1.83, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-acetyl-2,3-dihydroindol-6-yl)-2-oxo-3H-1,3-benzoxazole-6-sulfonamide is sourced from PubChem (CID 110288193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).