N-(7-methoxy-1-methyl-2-oxoquinolin-6-yl)benzenesulfonamide

C17H16N2O4S — CID 118932979

IUPACN-(7-methoxy-1-methyl-2-oxoquinolin-6-yl)benzenesulfonamide
SMILESCOc1cc2c(ccc(=O)n2C)cc1NS(=O)(=O)c1ccccc1
InChIInChI=1S/C17H16N2O4S/c1-19-15-11-16(23-2)14(10-12(15)8-9-17(19)20)18-24(21,22)13-6-4-3-5-7-13/h3-11,18H,1-2H3
InChIKeyFFVNHKQONMKRRU-UHFFFAOYSA-N
MW344.39 g/mol
LogP2.35
Rot. Bonds4

About N-(7-methoxy-1-methyl-2-oxoquinolin-6-yl)benzenesulfonamide

N-(7-methoxy-1-methyl-2-oxoquinolin-6-yl)benzenesulfonamide (PubChem CID 118932979) has the molecular formula C17H16N2O4S and a molecular weight of 344.39 g/mol. Its IUPAC name is N-(7-methoxy-1-methyl-2-oxoquinolin-6-yl)benzenesulfonamide.

Molecular Properties

Compound NameN-(7-methoxy-1-methyl-2-oxoquinolin-6-yl)benzenesulfonamide
PubChem CID118932979
Molecular FormulaC17H16N2O4S
Molecular Weight344.39 g/mol
Exact Mass344.08
IUPAC NameN-(7-methoxy-1-methyl-2-oxoquinolin-6-yl)benzenesulfonamide
SMILESCOc1cc2c(ccc(=O)n2C)cc1NS(=O)(=O)c1ccccc1
InChIInChI=1S/C17H16N2O4S/c1-19-15-11-16(23-2)14(10-12(15)8-9-17(19)20)18-24(21,22)13-6-4-3-5-7-13/h3-11,18H,1-2H3
InChIKeyFFVNHKQONMKRRU-UHFFFAOYSA-N
XLogP2.35
TPSA77.40 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.39
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(7-methoxy-1-methyl-2-oxoquinolin-6-yl)benzenesulfonamide?
The IUPAC name of N-(7-methoxy-1-methyl-2-oxoquinolin-6-yl)benzenesulfonamide (CID 118932979) is N-(7-methoxy-1-methyl-2-oxoquinolin-6-yl)benzenesulfonamide.
What is the SMILES notation for N-(7-methoxy-1-methyl-2-oxoquinolin-6-yl)benzenesulfonamide?
The canonical SMILES for N-(7-methoxy-1-methyl-2-oxoquinolin-6-yl)benzenesulfonamide is COc1cc2c(ccc(=O)n2C)cc1NS(=O)(=O)c1ccccc1.
What is the InChIKey of N-(7-methoxy-1-methyl-2-oxoquinolin-6-yl)benzenesulfonamide?
The InChIKey is FFVNHKQONMKRRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O4S/c1-19-15-11-16(23-2)14(10-12(15)8-9-17(19)20)18-24(21,22)13-6-4-3-5-7-13/h3-11,18H,1-2H3.
What are the key properties of N-(7-methoxy-1-methyl-2-oxoquinolin-6-yl)benzenesulfonamide?
N-(7-methoxy-1-methyl-2-oxoquinolin-6-yl)benzenesulfonamide has a molecular weight of 344.39 g/mol, XLogP of 2.35, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(7-methoxy-1-methyl-2-oxoquinolin-6-yl)benzenesulfonamide is sourced from PubChem (CID 118932979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).