2,3-dichloro-N-(3-chloro-7-methoxyquinoxalin-2-yl)benzenesulfonamide

C15H10Cl3N3O3S — CID 86612114

IUPAC2,3-dichloro-N-(3-chloro-7-methoxyquinoxalin-2-yl)benzenesulfonamide
SMILESCOc1ccc2nc(Cl)c(NS(=O)(=O)c3cccc(Cl)c3Cl)nc2c1
InChIInChI=1S/C15H10Cl3N3O3S/c1-24-8-5-6-10-11(7-8)20-15(14(18)19-10)21-25(22,23)12-4-2-3-9(16)13(12)17/h2-7H,1H3,(H,20,21)
InChIKeyFROFOLMQIGYCMT-UHFFFAOYSA-N
MW418.69 g/mol
LogP4.40
Rot. Bonds4

About 2,3-dichloro-N-(3-chloro-7-methoxyquinoxalin-2-yl)benzenesulfonamide

2,3-dichloro-N-(3-chloro-7-methoxyquinoxalin-2-yl)benzenesulfonamide (PubChem CID 86612114) has the molecular formula C15H10Cl3N3O3S and a molecular weight of 418.69 g/mol. Its IUPAC name is 2,3-dichloro-N-(3-chloro-7-methoxyquinoxalin-2-yl)benzenesulfonamide.

Molecular Properties

Compound Name2,3-dichloro-N-(3-chloro-7-methoxyquinoxalin-2-yl)benzenesulfonamide
PubChem CID86612114
Molecular FormulaC15H10Cl3N3O3S
Molecular Weight418.69 g/mol
Exact Mass416.95
IUPAC Name2,3-dichloro-N-(3-chloro-7-methoxyquinoxalin-2-yl)benzenesulfonamide
SMILESCOc1ccc2nc(Cl)c(NS(=O)(=O)c3cccc(Cl)c3Cl)nc2c1
InChIInChI=1S/C15H10Cl3N3O3S/c1-24-8-5-6-10-11(7-8)20-15(14(18)19-10)21-25(22,23)12-4-2-3-9(16)13(12)17/h2-7H,1H3,(H,20,21)
InChIKeyFROFOLMQIGYCMT-UHFFFAOYSA-N
XLogP4.40
TPSA81.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.69
LogP ≤ 54.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-chloro-N-(3-chloro-6,7-dimethylquinoxalin-2-yl)benzenesulfonamide
CID 86657925
2,3-dichloro-N-(3-chloro-6-methoxy-1,2,4-triazin-5-yl)benzenesulfonamide
CID 11222445
2,3-dichloro-N-(5-chloro-2-methoxy-6-oxo-1H-pyrazin-3-yl)benzenesulfonamide
CID 10194044
N-butyl-3-chloro-7-methoxyquinoxalin-2-amine
CID 86055666
N-[5,6-bis(hydroxymethyl)-3-methoxypyrazin-2-yl]-2,3-dichlorobenzenesulfonamide
CID 10309586
3-chloro-5-[(2,3-dichlorophenyl)sulfonylamino]-6-methoxypyrazine-2-carboxylic acid
CID 87284462
2,3-dichloro-N-[3-(2,4-dimethylpentan-3-yloxy)quinoxalin-2-yl]benzenesulfonamide
CID 67403098
2,3-dichloro-N-[3-(4-methoxyphenyl)-2-methyl-4-oxoquinazolin-6-yl]benzenesulfonamide
CID 30867596
5-[(2,3-dichlorophenyl)sulfonylamino]-6-methoxypyrazine-2,3-dicarboxylic acid
CID 67139114
N-(5-bromo-3-methoxy-6-methylpyrazin-2-yl)-2,3-dichlorobenzenesulfonamide
CID 59168221
2,3-dichloro-N-(3-methoxy-5-methylsulfonylpyrazin-2-yl)benzenesulfonamide
CID 59168213
2,3-dichloro-N-(3-chloropyrazin-2-yl)benzenesulfonamide
CID 59168167

Frequently Asked Questions

What is the IUPAC name of 2,3-dichloro-N-(3-chloro-7-methoxyquinoxalin-2-yl)benzenesulfonamide?
The IUPAC name of 2,3-dichloro-N-(3-chloro-7-methoxyquinoxalin-2-yl)benzenesulfonamide (CID 86612114) is 2,3-dichloro-N-(3-chloro-7-methoxyquinoxalin-2-yl)benzenesulfonamide.
What is the SMILES notation for 2,3-dichloro-N-(3-chloro-7-methoxyquinoxalin-2-yl)benzenesulfonamide?
The canonical SMILES for 2,3-dichloro-N-(3-chloro-7-methoxyquinoxalin-2-yl)benzenesulfonamide is COc1ccc2nc(Cl)c(NS(=O)(=O)c3cccc(Cl)c3Cl)nc2c1.
What is the InChIKey of 2,3-dichloro-N-(3-chloro-7-methoxyquinoxalin-2-yl)benzenesulfonamide?
The InChIKey is FROFOLMQIGYCMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10Cl3N3O3S/c1-24-8-5-6-10-11(7-8)20-15(14(18)19-10)21-25(22,23)12-4-2-3-9(16)13(12)17/h2-7H,1H3,(H,20,21).
What are the key properties of 2,3-dichloro-N-(3-chloro-7-methoxyquinoxalin-2-yl)benzenesulfonamide?
2,3-dichloro-N-(3-chloro-7-methoxyquinoxalin-2-yl)benzenesulfonamide has a molecular weight of 418.69 g/mol, XLogP of 4.40, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dichloro-N-(3-chloro-7-methoxyquinoxalin-2-yl)benzenesulfonamide is sourced from PubChem (CID 86612114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).