N-ethyl-2,3-dioxo-N-phenyl-1,4-dihydroquinoxaline-6-sulfonamide

C16H15N3O4S — CID 3661670

IUPACN-ethyl-2,3-dioxo-N-phenyl-1,4-dihydroquinoxaline-6-sulfonamide
SMILESCCN(c1ccccc1)S(=O)(=O)c1ccc2[nH]c(=O)c(=O)[nH]c2c1
InChIInChI=1S/C16H15N3O4S/c1-2-19(11-6-4-3-5-7-11)24(22,23)12-8-9-13-14(10-12)18-16(21)15(20)17-13/h3-10H,2H2,1H3,(H,17,20)(H,18,21)
InChIKeyCSTXQZRXJWBRCN-UHFFFAOYSA-N
MW345.38 g/mol
LogP1.43
Rot. Bonds4

About N-ethyl-2,3-dioxo-N-phenyl-1,4-dihydroquinoxaline-6-sulfonamide

N-ethyl-2,3-dioxo-N-phenyl-1,4-dihydroquinoxaline-6-sulfonamide (PubChem CID 3661670) has the molecular formula C16H15N3O4S and a molecular weight of 345.38 g/mol. Its IUPAC name is N-ethyl-2,3-dioxo-N-phenyl-1,4-dihydroquinoxaline-6-sulfonamide.

Molecular Properties

Compound NameN-ethyl-2,3-dioxo-N-phenyl-1,4-dihydroquinoxaline-6-sulfonamide
PubChem CID3661670
Molecular FormulaC16H15N3O4S
Molecular Weight345.38 g/mol
Exact Mass345.08
IUPAC NameN-ethyl-2,3-dioxo-N-phenyl-1,4-dihydroquinoxaline-6-sulfonamide
SMILESCCN(c1ccccc1)S(=O)(=O)c1ccc2[nH]c(=O)c(=O)[nH]c2c1
InChIInChI=1S/C16H15N3O4S/c1-2-19(11-6-4-3-5-7-11)24(22,23)12-8-9-13-14(10-12)18-16(21)15(20)17-13/h3-10H,2H2,1H3,(H,17,20)(H,18,21)
InChIKeyCSTXQZRXJWBRCN-UHFFFAOYSA-N
XLogP1.43
TPSA103.10 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.38
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

Analyze N-ethyl-2,3-dioxo-N-phenyl-1,4-dihydroquinoxaline-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

4-(Benzenesulfonyl)-1,3-dihydroquinoxalin-2-one
CID 1093237
4-(4-Fluorophenyl)sulfonyl-1,3-dihydroquinoxalin-2-one
CID 1093238
2-(4-phenylpiperazin-1-yl)-N-(4-sulfamoylphenyl)acetamide
CID 1241259
6-[4-(2,6-Difluorophenyl)sulfonylpiperazin-1-yl]sulfonyl-1,4-dihydroquinoxaline-2,3-dione
CID 31760204
2-Azepan-1-yl-N-[4-(piperidine-1-sulfonyl)-phenyl]-acetamide
CID 1152663
N-(2,3-Dioxo-1,2,3,4-tetrahydroquinoxaline-6-sulfonyl)glycine
CID 2064173
N-(5-morpholin-4-ylsulfonyl-2-piperidin-1-ylphenyl)butanamide
CID 4296426
4-(4-Methylsulfanyl-benzenesulfonyl)-3,4-dihydro-1H-quinoxalin-2-one
CID 6494066
N,N-diethyl-4-oxo-1,2,3,3a,4,5-hexahydropyrrolo[1,2-a]quinoxaline-7-sulfonamide
CID 20888101
N-(2,4-difluorophenyl)-2-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]acetamide
CID 4824613
N-methyl-N-(3-methylphenyl)-2,3-dioxo-1,2,3,4-tetrahydroquinoxaline-6-sulfonamide
CID 3238453
N-(4-bromophenyl)-N-methyl-2,3-dioxo-1,4-dihydroquinoxaline-6-sulfonamide
CID 3317983

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2,3-dioxo-N-phenyl-1,4-dihydroquinoxaline-6-sulfonamide?
The IUPAC name of N-ethyl-2,3-dioxo-N-phenyl-1,4-dihydroquinoxaline-6-sulfonamide (CID 3661670) is N-ethyl-2,3-dioxo-N-phenyl-1,4-dihydroquinoxaline-6-sulfonamide.
What is the SMILES notation for N-ethyl-2,3-dioxo-N-phenyl-1,4-dihydroquinoxaline-6-sulfonamide?
The canonical SMILES for N-ethyl-2,3-dioxo-N-phenyl-1,4-dihydroquinoxaline-6-sulfonamide is CCN(c1ccccc1)S(=O)(=O)c1ccc2[nH]c(=O)c(=O)[nH]c2c1.
What is the InChIKey of N-ethyl-2,3-dioxo-N-phenyl-1,4-dihydroquinoxaline-6-sulfonamide?
The InChIKey is CSTXQZRXJWBRCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O4S/c1-2-19(11-6-4-3-5-7-11)24(22,23)12-8-9-13-14(10-12)18-16(21)15(20)17-13/h3-10H,2H2,1H3,(H,17,20)(H,18,21).
What are the key properties of N-ethyl-2,3-dioxo-N-phenyl-1,4-dihydroquinoxaline-6-sulfonamide?
N-ethyl-2,3-dioxo-N-phenyl-1,4-dihydroquinoxaline-6-sulfonamide has a molecular weight of 345.38 g/mol, XLogP of 1.43, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,3-dioxo-N-phenyl-1,4-dihydroquinoxaline-6-sulfonamide is sourced from PubChem (CID 3661670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).