4-(4-methoxyphenyl)sulfonyl-1,3-dihydroquinoxalin-2-one

C15H14N2O4S — CID 1082645

IUPAC4-(4-methoxyphenyl)sulfonyl-1,3-dihydroquinoxalin-2-one
SMILESCOc1ccc(S(=O)(=O)N2CC(=O)Nc3ccccc32)cc1
InChIInChI=1S/C15H14N2O4S/c1-21-11-6-8-12(9-7-11)22(19,20)17-10-15(18)16-13-4-2-3-5-14(13)17/h2-9H,10H2,1H3,(H,16,18)
InChIKeyDZOFFEQVUCGOGE-UHFFFAOYSA-N
MW318.35 g/mol
LogP1.84
Rot. Bonds3

About 4-(4-methoxyphenyl)sulfonyl-1,3-dihydroquinoxalin-2-one

4-(4-methoxyphenyl)sulfonyl-1,3-dihydroquinoxalin-2-one (PubChem CID 1082645) has the molecular formula C15H14N2O4S and a molecular weight of 318.35 g/mol. Its IUPAC name is 4-(4-methoxyphenyl)sulfonyl-1,3-dihydroquinoxalin-2-one.

Molecular Properties

Compound Name4-(4-methoxyphenyl)sulfonyl-1,3-dihydroquinoxalin-2-one
PubChem CID1082645
Molecular FormulaC15H14N2O4S
Molecular Weight318.35 g/mol
Exact Mass318.07
IUPAC Name4-(4-methoxyphenyl)sulfonyl-1,3-dihydroquinoxalin-2-one
SMILESCOc1ccc(S(=O)(=O)N2CC(=O)Nc3ccccc32)cc1
InChIInChI=1S/C15H14N2O4S/c1-21-11-6-8-12(9-7-11)22(19,20)17-10-15(18)16-13-4-2-3-5-14(13)17/h2-9H,10H2,1H3,(H,16,18)
InChIKeyDZOFFEQVUCGOGE-UHFFFAOYSA-N
XLogP1.84
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.35
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-(4-methoxyphenyl)sulfonyl-1,3-dihydroquinoxalin-2-one 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-(4-Methoxyphenyl)sulfonyl-4-phenylpiperazine
CID 756017
N-(3-methoxyphenyl)-N-methyl-2,3-dioxo-1,4-dihydroquinoxaline-6-sulfonamide
CID 129274553
2-(carbamoylamino)-N-[5-[(4-methoxyphenyl)sulfamoyl]-2-piperidin-1-ylphenyl]propanamide
CID 4291895
N-(2-ethoxyphenyl)-3-{4-[(4-methoxyphenyl)sulfonyl]piperazin-1-yl}propanamide
CID 3245222
4-[(2-fluoro-4,5-dimethoxyphenyl)sulfonyl]-3,4-dihydroquinoxalin-2(1H)-one
CID 5301682
N-(4-Ethoxyphenyl)-3-[4-(4-methoxybenzenesulfonyl)piperazin-1-YL]propanamide
CID 9550798
4-Methoxy-N-{3-[4-(o-fluorophenyl)-piperazin-1-yl]-propyl}-benzenesulfonamide
CID 42388975
4-Methoxy-N-{3-[4-(p-fluorophenyl)-piperazin-1-yl]-propyl}-benzenesulfonamide
CID 42389467
4-Methoxy-N-[3-(4-phenyl-piperazin-1-yl)-1-methyl-propyl]-benzenesulfonamide
CID 42635572
2-(4-Methoxy-benzenesulfonylamino)-N-phenyl-N-{[(tetrahydro-furan-2-ylmethyl)-carbamoyl]-methyl}-acetamide
CID 649466
N-(2-Methoxy-phenyl)-N-(2-oxo-2-piperidin-1-yl-ethyl)-benzenesulfonamide
CID 651524
N-(3-methoxyphenyl)-N-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]benzenesulfonamide
CID 651560

Frequently Asked Questions

What is the IUPAC name of 4-(4-methoxyphenyl)sulfonyl-1,3-dihydroquinoxalin-2-one?
The IUPAC name of 4-(4-methoxyphenyl)sulfonyl-1,3-dihydroquinoxalin-2-one (CID 1082645) is 4-(4-methoxyphenyl)sulfonyl-1,3-dihydroquinoxalin-2-one.
What is the SMILES notation for 4-(4-methoxyphenyl)sulfonyl-1,3-dihydroquinoxalin-2-one?
The canonical SMILES for 4-(4-methoxyphenyl)sulfonyl-1,3-dihydroquinoxalin-2-one is COc1ccc(S(=O)(=O)N2CC(=O)Nc3ccccc32)cc1.
What is the InChIKey of 4-(4-methoxyphenyl)sulfonyl-1,3-dihydroquinoxalin-2-one?
The InChIKey is DZOFFEQVUCGOGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O4S/c1-21-11-6-8-12(9-7-11)22(19,20)17-10-15(18)16-13-4-2-3-5-14(13)17/h2-9H,10H2,1H3,(H,16,18).
What are the key properties of 4-(4-methoxyphenyl)sulfonyl-1,3-dihydroquinoxalin-2-one?
4-(4-methoxyphenyl)sulfonyl-1,3-dihydroquinoxalin-2-one has a molecular weight of 318.35 g/mol, XLogP of 1.84, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methoxyphenyl)sulfonyl-1,3-dihydroquinoxalin-2-one is sourced from PubChem (CID 1082645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).