2-oxo-N-(3-pyrazin-2-yloxyphenyl)-1,3-dihydroindole-5-sulfonamide

C18H14N4O4S — CID 39836329

IUPAC2-oxo-N-(3-pyrazin-2-yloxyphenyl)-1,3-dihydroindole-5-sulfonamide
SMILESO=C1Cc2cc(S(=O)(=O)Nc3cccc(Oc4cnccn4)c3)ccc2N1
InChIInChI=1S/C18H14N4O4S/c23-17-9-12-8-15(4-5-16(12)21-17)27(24,25)22-13-2-1-3-14(10-13)26-18-11-19-6-7-20-18/h1-8,10-11,22H,9H2,(H,21,23)
InChIKeySFANBSWCTLKOTK-UHFFFAOYSA-N
MW382.40 g/mol
LogP2.56
Rot. Bonds5

About 2-oxo-N-(3-pyrazin-2-yloxyphenyl)-1,3-dihydroindole-5-sulfonamide

2-oxo-N-(3-pyrazin-2-yloxyphenyl)-1,3-dihydroindole-5-sulfonamide (PubChem CID 39836329) has the molecular formula C18H14N4O4S and a molecular weight of 382.40 g/mol. Its IUPAC name is 2-oxo-N-(3-pyrazin-2-yloxyphenyl)-1,3-dihydroindole-5-sulfonamide.

Molecular Properties

Compound Name2-oxo-N-(3-pyrazin-2-yloxyphenyl)-1,3-dihydroindole-5-sulfonamide
PubChem CID39836329
Molecular FormulaC18H14N4O4S
Molecular Weight382.40 g/mol
Exact Mass382.07
IUPAC Name2-oxo-N-(3-pyrazin-2-yloxyphenyl)-1,3-dihydroindole-5-sulfonamide
SMILESO=C1Cc2cc(S(=O)(=O)Nc3cccc(Oc4cnccn4)c3)ccc2N1
InChIInChI=1S/C18H14N4O4S/c23-17-9-12-8-15(4-5-16(12)21-17)27(24,25)22-13-2-1-3-14(10-13)26-18-11-19-6-7-20-18/h1-8,10-11,22H,9H2,(H,21,23)
InChIKeySFANBSWCTLKOTK-UHFFFAOYSA-N
XLogP2.56
TPSA110.28 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.40
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-oxo-N-(3-pyrazin-2-yloxyphenyl)-1,3-dihydroindole-5-sulfonamide?
The IUPAC name of 2-oxo-N-(3-pyrazin-2-yloxyphenyl)-1,3-dihydroindole-5-sulfonamide (CID 39836329) is 2-oxo-N-(3-pyrazin-2-yloxyphenyl)-1,3-dihydroindole-5-sulfonamide.
What is the SMILES notation for 2-oxo-N-(3-pyrazin-2-yloxyphenyl)-1,3-dihydroindole-5-sulfonamide?
The canonical SMILES for 2-oxo-N-(3-pyrazin-2-yloxyphenyl)-1,3-dihydroindole-5-sulfonamide is O=C1Cc2cc(S(=O)(=O)Nc3cccc(Oc4cnccn4)c3)ccc2N1.
What is the InChIKey of 2-oxo-N-(3-pyrazin-2-yloxyphenyl)-1,3-dihydroindole-5-sulfonamide?
The InChIKey is SFANBSWCTLKOTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N4O4S/c23-17-9-12-8-15(4-5-16(12)21-17)27(24,25)22-13-2-1-3-14(10-13)26-18-11-19-6-7-20-18/h1-8,10-11,22H,9H2,(H,21,23).
What are the key properties of 2-oxo-N-(3-pyrazin-2-yloxyphenyl)-1,3-dihydroindole-5-sulfonamide?
2-oxo-N-(3-pyrazin-2-yloxyphenyl)-1,3-dihydroindole-5-sulfonamide has a molecular weight of 382.40 g/mol, XLogP of 2.56, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-N-(3-pyrazin-2-yloxyphenyl)-1,3-dihydroindole-5-sulfonamide is sourced from PubChem (CID 39836329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).