N-(6-chloro-2-oxo-1,3-dihydroindol-5-yl)-4-ethoxybenzenesulfonamide

C16H15ClN2O4S — CID 39339831

IUPACN-(6-chloro-2-oxo-1,3-dihydroindol-5-yl)-4-ethoxybenzenesulfonamide
SMILESCCOc1ccc(S(=O)(=O)Nc2cc3c(cc2Cl)NC(=O)C3)cc1
InChIInChI=1S/C16H15ClN2O4S/c1-2-23-11-3-5-12(6-4-11)24(21,22)19-15-7-10-8-16(20)18-14(10)9-13(15)17/h3-7,9,19H,2,8H2,1H3,(H,18,20)
InChIKeyRPTRDTCSKBXHCL-UHFFFAOYSA-N
MW366.83 g/mol
LogP3.03
Rot. Bonds5

About N-(6-chloro-2-oxo-1,3-dihydroindol-5-yl)-4-ethoxybenzenesulfonamide

N-(6-chloro-2-oxo-1,3-dihydroindol-5-yl)-4-ethoxybenzenesulfonamide (PubChem CID 39339831) has the molecular formula C16H15ClN2O4S and a molecular weight of 366.83 g/mol. Its IUPAC name is N-(6-chloro-2-oxo-1,3-dihydroindol-5-yl)-4-ethoxybenzenesulfonamide.

Molecular Properties

Compound NameN-(6-chloro-2-oxo-1,3-dihydroindol-5-yl)-4-ethoxybenzenesulfonamide
PubChem CID39339831
Molecular FormulaC16H15ClN2O4S
Molecular Weight366.83 g/mol
Exact Mass366.04
IUPAC NameN-(6-chloro-2-oxo-1,3-dihydroindol-5-yl)-4-ethoxybenzenesulfonamide
SMILESCCOc1ccc(S(=O)(=O)Nc2cc3c(cc2Cl)NC(=O)C3)cc1
InChIInChI=1S/C16H15ClN2O4S/c1-2-23-11-3-5-12(6-4-11)24(21,22)19-15-7-10-8-16(20)18-14(10)9-13(15)17/h3-7,9,19H,2,8H2,1H3,(H,18,20)
InChIKeyRPTRDTCSKBXHCL-UHFFFAOYSA-N
XLogP3.03
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.83
LogP ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(4-ethoxyphenoxy)phenyl]-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 18197732
N-(2-chloro-4-methylphenyl)-4-ethoxybenzenesulfonamide
CID 7514268
N-(6-chloro-2-oxo-1,3-dihydroindol-5-yl)-2-methyl-1H-imidazole-5-sulfonamide
CID 62998938
6-chloro-5-(propylamino)-1,3-dihydroindol-2-one
CID 43691797
N-(4-chloro-2-methoxyphenyl)-4-ethoxybenzenesulfonamide
CID 155537500
(2R)-2-(4-ethoxyphenoxy)-N'-[(2-oxo-1,3-dihydroindol-5-yl)sulfonyl]propanehydrazide
CID 9056044
N-[(4-ethoxyphenyl)methyl]-2,4-dioxo-1,5-dihydro-1,5-benzodiazepine-7-sulfonamide
CID 46341346
N-(2-chloro-3-pyridinyl)-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 16562517
N-(5-ethyl-2-methoxyphenyl)-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 110777264
4-ethoxy-N-(2-ethoxyphenyl)benzenesulfonamide
CID 7559506
5,6-diethoxy-1,3-dihydroindol-2-one
CID 22668692
ethyl 4-[6-(benzenesulfonamido)-2-oxo-1,3-dihydroindol-5-yl]piperazine-1-carboxylate
CID 102156521

Frequently Asked Questions

What is the IUPAC name of N-(6-chloro-2-oxo-1,3-dihydroindol-5-yl)-4-ethoxybenzenesulfonamide?
The IUPAC name of N-(6-chloro-2-oxo-1,3-dihydroindol-5-yl)-4-ethoxybenzenesulfonamide (CID 39339831) is N-(6-chloro-2-oxo-1,3-dihydroindol-5-yl)-4-ethoxybenzenesulfonamide.
What is the SMILES notation for N-(6-chloro-2-oxo-1,3-dihydroindol-5-yl)-4-ethoxybenzenesulfonamide?
The canonical SMILES for N-(6-chloro-2-oxo-1,3-dihydroindol-5-yl)-4-ethoxybenzenesulfonamide is CCOc1ccc(S(=O)(=O)Nc2cc3c(cc2Cl)NC(=O)C3)cc1.
What is the InChIKey of N-(6-chloro-2-oxo-1,3-dihydroindol-5-yl)-4-ethoxybenzenesulfonamide?
The InChIKey is RPTRDTCSKBXHCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClN2O4S/c1-2-23-11-3-5-12(6-4-11)24(21,22)19-15-7-10-8-16(20)18-14(10)9-13(15)17/h3-7,9,19H,2,8H2,1H3,(H,18,20).
What are the key properties of N-(6-chloro-2-oxo-1,3-dihydroindol-5-yl)-4-ethoxybenzenesulfonamide?
N-(6-chloro-2-oxo-1,3-dihydroindol-5-yl)-4-ethoxybenzenesulfonamide has a molecular weight of 366.83 g/mol, XLogP of 3.03, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-chloro-2-oxo-1,3-dihydroindol-5-yl)-4-ethoxybenzenesulfonamide is sourced from PubChem (CID 39339831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).