2,3-dichloro-N-[5-chloro-3-[(6-methoxy-3-pyridinyl)methoxy]pyrazin-2-yl]benzenesulfonamide

C17H13Cl3N4O4S — CID 10288760

IUPAC2,3-dichloro-N-[5-chloro-3-[(6-methoxy-3-pyridinyl)methoxy]pyrazin-2-yl]benzenesulfonamide
SMILESCOc1ccc(COc2nc(Cl)cnc2NS(=O)(=O)c2cccc(Cl)c2Cl)cn1
InChIInChI=1S/C17H13Cl3N4O4S/c1-27-14-6-5-10(7-21-14)9-28-17-16(22-8-13(19)23-17)24-29(25,26)12-4-2-3-11(18)15(12)20/h2-8H,9H2,1H3,(H,22,24)
InChIKeyJPMOHZLHZAESSA-UHFFFAOYSA-N
MW475.74 g/mol
LogP4.22
Rot. Bonds7

About 2,3-dichloro-N-[5-chloro-3-[(6-methoxy-3-pyridinyl)methoxy]pyrazin-2-yl]benzenesulfonamide

2,3-dichloro-N-[5-chloro-3-[(6-methoxy-3-pyridinyl)methoxy]pyrazin-2-yl]benzenesulfonamide (PubChem CID 10288760) has the molecular formula C17H13Cl3N4O4S and a molecular weight of 475.74 g/mol. Its IUPAC name is 2,3-dichloro-N-[5-chloro-3-[(6-methoxy-3-pyridinyl)methoxy]pyrazin-2-yl]benzenesulfonamide.

Molecular Properties

Compound Name2,3-dichloro-N-[5-chloro-3-[(6-methoxy-3-pyridinyl)methoxy]pyrazin-2-yl]benzenesulfonamide
PubChem CID10288760
Molecular FormulaC17H13Cl3N4O4S
Molecular Weight475.74 g/mol
Exact Mass473.97
IUPAC Name2,3-dichloro-N-[5-chloro-3-[(6-methoxy-3-pyridinyl)methoxy]pyrazin-2-yl]benzenesulfonamide
SMILESCOc1ccc(COc2nc(Cl)cnc2NS(=O)(=O)c2cccc(Cl)c2Cl)cn1
InChIInChI=1S/C17H13Cl3N4O4S/c1-27-14-6-5-10(7-21-14)9-28-17-16(22-8-13(19)23-17)24-29(25,26)12-4-2-3-11(18)15(12)20/h2-8H,9H2,1H3,(H,22,24)
InChIKeyJPMOHZLHZAESSA-UHFFFAOYSA-N
XLogP4.22
TPSA103.30 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500475.74
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 2,3-dichloro-N-[5-chloro-3-[(6-methoxy-3-pyridinyl)methoxy]pyrazin-2-yl]benzenesulfonamide with MolForge

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Launch Full Analysis

Related Compounds

N-[5-Chloro-3-(3-pyridinylmethoxy)-2-pyrazinyl]-2,3-dichlorobenzenesulphonamide
CID 10195057
3-chloro-2-fluoro-N-[3-(pyridin-3-ylmethoxy)pyrazin-2-yl]benzenesulfonamide
CID 10237577
3-Chloro-N-[5-chloro-3-(3-pyridinylmethoxy)-2-pyrazinyl]-2-fluorobenzenesulphonamide
CID 59168161
2-chloro-N-[3-[2,2,2-trifluoro-1-(6-methoxypyridin-3-yl)ethoxy]quinoxalin-2-yl]benzenesulfonamide
CID 67401451
2,3-dichloro-N-[5-methoxy-3-(2,2,2-trifluoro-1-pyridin-3-ylethoxy)pyrazin-2-yl]benzenesulfonamide
CID 67401692
2,3-dichloro-N-[3-(2-fluoro-2-methyl-1-pyridin-3-ylpropoxy)quinoxalin-2-yl]benzenesulfonamide
CID 67401945
2,3-dichloro-N-[3-(2,2,2-trifluoro-1-pyridin-3-ylethoxy)quinoxalin-2-yl]benzenesulfonamide
CID 67401973
2,3-dichloro-N-[6-methoxy-2-(2,2,2-trifluoro-1-pyridin-3-ylethoxy)pyridin-3-yl]benzenesulfonamide
CID 68241850
N-[5-[4-(aminomethyl)-3-fluorophenoxy]-3-ethoxypyrazin-2-yl]-2,3-dichlorobenzenesulfonamide
CID 69407531
2,3-dichloro-N-[5-[3-fluoro-4-(methylaminomethyl)phenoxy]-3-methoxypyrazin-2-yl]benzenesulfonamide
CID 71206513
2,3-dichloro-N-[5-chloro-3-(2,2,2-trifluoro-1-pyridin-3-ylethoxy)pyrazin-2-yl]benzenesulfonamide
CID 87386381
N-[2-(5-aminopyrazin-2-yl)oxy-5-methyl-3-pyridinyl]-4-chloro-3-(trifluoromethyl)benzenesulfonamide
CID 167495978

Frequently Asked Questions

What is the IUPAC name of 2,3-dichloro-N-[5-chloro-3-[(6-methoxy-3-pyridinyl)methoxy]pyrazin-2-yl]benzenesulfonamide?
The IUPAC name of 2,3-dichloro-N-[5-chloro-3-[(6-methoxy-3-pyridinyl)methoxy]pyrazin-2-yl]benzenesulfonamide (CID 10288760) is 2,3-dichloro-N-[5-chloro-3-[(6-methoxy-3-pyridinyl)methoxy]pyrazin-2-yl]benzenesulfonamide.
What is the SMILES notation for 2,3-dichloro-N-[5-chloro-3-[(6-methoxy-3-pyridinyl)methoxy]pyrazin-2-yl]benzenesulfonamide?
The canonical SMILES for 2,3-dichloro-N-[5-chloro-3-[(6-methoxy-3-pyridinyl)methoxy]pyrazin-2-yl]benzenesulfonamide is COc1ccc(COc2nc(Cl)cnc2NS(=O)(=O)c2cccc(Cl)c2Cl)cn1.
What is the InChIKey of 2,3-dichloro-N-[5-chloro-3-[(6-methoxy-3-pyridinyl)methoxy]pyrazin-2-yl]benzenesulfonamide?
The InChIKey is JPMOHZLHZAESSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13Cl3N4O4S/c1-27-14-6-5-10(7-21-14)9-28-17-16(22-8-13(19)23-17)24-29(25,26)12-4-2-3-11(18)15(12)20/h2-8H,9H2,1H3,(H,22,24).
What are the key properties of 2,3-dichloro-N-[5-chloro-3-[(6-methoxy-3-pyridinyl)methoxy]pyrazin-2-yl]benzenesulfonamide?
2,3-dichloro-N-[5-chloro-3-[(6-methoxy-3-pyridinyl)methoxy]pyrazin-2-yl]benzenesulfonamide has a molecular weight of 475.74 g/mol, XLogP of 4.22, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dichloro-N-[5-chloro-3-[(6-methoxy-3-pyridinyl)methoxy]pyrazin-2-yl]benzenesulfonamide is sourced from PubChem (CID 10288760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).