N-(6-phenylpyridazin-3-yl)pyridine-3-sulfonamide

C15H12N4O2S — CID 86806095

IUPACN-(6-phenylpyridazin-3-yl)pyridine-3-sulfonamide
SMILESO=S(=O)(Nc1ccc(-c2ccccc2)nn1)c1cccnc1
InChIInChI=1S/C15H12N4O2S/c20-22(21,13-7-4-10-16-11-13)19-15-9-8-14(17-18-15)12-5-2-1-3-6-12/h1-11H,(H,18,19)
InChIKeyHLTUAISWWUYPQU-UHFFFAOYSA-N
MW312.35 g/mol
LogP2.34
Rot. Bonds4

About N-(6-phenylpyridazin-3-yl)pyridine-3-sulfonamide

N-(6-phenylpyridazin-3-yl)pyridine-3-sulfonamide (PubChem CID 86806095) has the molecular formula C15H12N4O2S and a molecular weight of 312.35 g/mol. Its IUPAC name is N-(6-phenylpyridazin-3-yl)pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-(6-phenylpyridazin-3-yl)pyridine-3-sulfonamide
PubChem CID86806095
Molecular FormulaC15H12N4O2S
Molecular Weight312.35 g/mol
Exact Mass312.07
IUPAC NameN-(6-phenylpyridazin-3-yl)pyridine-3-sulfonamide
SMILESO=S(=O)(Nc1ccc(-c2ccccc2)nn1)c1cccnc1
InChIInChI=1S/C15H12N4O2S/c20-22(21,13-7-4-10-16-11-13)19-15-9-8-14(17-18-15)12-5-2-1-3-6-12/h1-11H,(H,18,19)
InChIKeyHLTUAISWWUYPQU-UHFFFAOYSA-N
XLogP2.34
TPSA84.84 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.35
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(6-phenylpyridazin-3-yl)pyridine-3-sulfonamide?
The IUPAC name of N-(6-phenylpyridazin-3-yl)pyridine-3-sulfonamide (CID 86806095) is N-(6-phenylpyridazin-3-yl)pyridine-3-sulfonamide.
What is the SMILES notation for N-(6-phenylpyridazin-3-yl)pyridine-3-sulfonamide?
The canonical SMILES for N-(6-phenylpyridazin-3-yl)pyridine-3-sulfonamide is O=S(=O)(Nc1ccc(-c2ccccc2)nn1)c1cccnc1.
What is the InChIKey of N-(6-phenylpyridazin-3-yl)pyridine-3-sulfonamide?
The InChIKey is HLTUAISWWUYPQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N4O2S/c20-22(21,13-7-4-10-16-11-13)19-15-9-8-14(17-18-15)12-5-2-1-3-6-12/h1-11H,(H,18,19).
What are the key properties of N-(6-phenylpyridazin-3-yl)pyridine-3-sulfonamide?
N-(6-phenylpyridazin-3-yl)pyridine-3-sulfonamide has a molecular weight of 312.35 g/mol, XLogP of 2.34, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-phenylpyridazin-3-yl)pyridine-3-sulfonamide is sourced from PubChem (CID 86806095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).