N-(5-chloropyrazin-2-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide

C12H9ClN4O3S — CID 103580637

IUPACN-(5-chloropyrazin-2-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide
SMILESO=C1Cc2cc(S(=O)(=O)Nc3cnc(Cl)cn3)ccc2N1
InChIInChI=1S/C12H9ClN4O3S/c13-10-5-15-11(6-14-10)17-21(19,20)8-1-2-9-7(3-8)4-12(18)16-9/h1-3,5-6H,4H2,(H,15,17)(H,16,18)
InChIKeyBCYVVXSRNKUHRR-UHFFFAOYSA-N
MW324.75 g/mol
LogP1.43
Rot. Bonds3

About N-(5-chloropyrazin-2-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide

N-(5-chloropyrazin-2-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide (PubChem CID 103580637) has the molecular formula C12H9ClN4O3S and a molecular weight of 324.75 g/mol. Its IUPAC name is N-(5-chloropyrazin-2-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide.

Molecular Properties

Compound NameN-(5-chloropyrazin-2-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide
PubChem CID103580637
Molecular FormulaC12H9ClN4O3S
Molecular Weight324.75 g/mol
Exact Mass324.01
IUPAC NameN-(5-chloropyrazin-2-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide
SMILESO=C1Cc2cc(S(=O)(=O)Nc3cnc(Cl)cn3)ccc2N1
InChIInChI=1S/C12H9ClN4O3S/c13-10-5-15-11(6-14-10)17-21(19,20)8-1-2-9-7(3-8)4-12(18)16-9/h1-3,5-6H,4H2,(H,15,17)(H,16,18)
InChIKeyBCYVVXSRNKUHRR-UHFFFAOYSA-N
XLogP1.43
TPSA101.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.75
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-chloro-2-pyridinyl)-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 115687703
2-oxo-N-pyridin-2-yl-1,3-dihydroindole-5-sulfonamide
CID 110756782
N-(3,4-dichlorophenyl)-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 9055840
N-(2-chloro-3-pyridinyl)-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 16562517
N-[6-(cyclopentylamino)pyridazin-3-yl]-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 113038925
N-(4-amino-3,5-dichlorophenyl)-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 8822885
N-(5-fluoro-3-pyridinyl)-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 110872393
2-oxo-N-[6-(prop-2-enylamino)pyridazin-3-yl]-1,3-dihydroindole-5-sulfonamide
CID 113038293
N-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 113024917
2-oxo-N-[6-(propylamino)-3-pyridinyl]-1,3-dihydroindole-5-sulfonamide
CID 113009145
N-cycloheptyl-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 20858702
N-[6-(azepan-1-yl)pyridazin-3-yl]-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 113045419

Frequently Asked Questions

What is the IUPAC name of N-(5-chloropyrazin-2-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide?
The IUPAC name of N-(5-chloropyrazin-2-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide (CID 103580637) is N-(5-chloropyrazin-2-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide.
What is the SMILES notation for N-(5-chloropyrazin-2-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide?
The canonical SMILES for N-(5-chloropyrazin-2-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide is O=C1Cc2cc(S(=O)(=O)Nc3cnc(Cl)cn3)ccc2N1.
What is the InChIKey of N-(5-chloropyrazin-2-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide?
The InChIKey is BCYVVXSRNKUHRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9ClN4O3S/c13-10-5-15-11(6-14-10)17-21(19,20)8-1-2-9-7(3-8)4-12(18)16-9/h1-3,5-6H,4H2,(H,15,17)(H,16,18).
What are the key properties of N-(5-chloropyrazin-2-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide?
N-(5-chloropyrazin-2-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide has a molecular weight of 324.75 g/mol, XLogP of 1.43, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloropyrazin-2-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide is sourced from PubChem (CID 103580637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).