5-(8-pyridin-4-yl-1,5-naphthyridin-2-yl)pyridine-3-sulfonamide

C18H13N5O2S — CID 59406554

IUPAC5-(8-pyridin-4-yl-1,5-naphthyridin-2-yl)pyridine-3-sulfonamide
SMILESNS(=O)(=O)c1cncc(-c2ccc3nccc(-c4ccncc4)c3n2)c1
InChIInChI=1S/C18H13N5O2S/c19-26(24,25)14-9-13(10-21-11-14)16-1-2-17-18(23-16)15(5-8-22-17)12-3-6-20-7-4-12/h1-11H,(H2,19,24,25)
InChIKeyBAKOSCHEPMUYGJ-UHFFFAOYSA-N
MW363.40 g/mol
LogP2.40
Rot. Bonds3

About 5-(8-pyridin-4-yl-1,5-naphthyridin-2-yl)pyridine-3-sulfonamide

5-(8-pyridin-4-yl-1,5-naphthyridin-2-yl)pyridine-3-sulfonamide (PubChem CID 59406554) has the molecular formula C18H13N5O2S and a molecular weight of 363.40 g/mol. Its IUPAC name is 5-(8-pyridin-4-yl-1,5-naphthyridin-2-yl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name5-(8-pyridin-4-yl-1,5-naphthyridin-2-yl)pyridine-3-sulfonamide
PubChem CID59406554
Molecular FormulaC18H13N5O2S
Molecular Weight363.40 g/mol
Exact Mass363.08
IUPAC Name5-(8-pyridin-4-yl-1,5-naphthyridin-2-yl)pyridine-3-sulfonamide
SMILESNS(=O)(=O)c1cncc(-c2ccc3nccc(-c4ccncc4)c3n2)c1
InChIInChI=1S/C18H13N5O2S/c19-26(24,25)14-9-13(10-21-11-14)16-1-2-17-18(23-16)15(5-8-22-17)12-3-6-20-7-4-12/h1-11H,(H2,19,24,25)
InChIKeyBAKOSCHEPMUYGJ-UHFFFAOYSA-N
XLogP2.40
TPSA111.72 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.40
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-(8-pyridin-4-yl-1,5-naphthyridin-2-yl)pyridine-3-sulfonamide?
The IUPAC name of 5-(8-pyridin-4-yl-1,5-naphthyridin-2-yl)pyridine-3-sulfonamide (CID 59406554) is 5-(8-pyridin-4-yl-1,5-naphthyridin-2-yl)pyridine-3-sulfonamide.
What is the SMILES notation for 5-(8-pyridin-4-yl-1,5-naphthyridin-2-yl)pyridine-3-sulfonamide?
The canonical SMILES for 5-(8-pyridin-4-yl-1,5-naphthyridin-2-yl)pyridine-3-sulfonamide is NS(=O)(=O)c1cncc(-c2ccc3nccc(-c4ccncc4)c3n2)c1.
What is the InChIKey of 5-(8-pyridin-4-yl-1,5-naphthyridin-2-yl)pyridine-3-sulfonamide?
The InChIKey is BAKOSCHEPMUYGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13N5O2S/c19-26(24,25)14-9-13(10-21-11-14)16-1-2-17-18(23-16)15(5-8-22-17)12-3-6-20-7-4-12/h1-11H,(H2,19,24,25).
What are the key properties of 5-(8-pyridin-4-yl-1,5-naphthyridin-2-yl)pyridine-3-sulfonamide?
5-(8-pyridin-4-yl-1,5-naphthyridin-2-yl)pyridine-3-sulfonamide has a molecular weight of 363.40 g/mol, XLogP of 2.40, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(8-pyridin-4-yl-1,5-naphthyridin-2-yl)pyridine-3-sulfonamide is sourced from PubChem (CID 59406554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).