N-[6-(4-pyridin-2-ylpiperazin-1-yl)pyridazin-3-yl]benzenesulfonamide

C19H20N6O2S — CID 113043896

IUPACN-[6-(4-pyridin-2-ylpiperazin-1-yl)pyridazin-3-yl]benzenesulfonamide
SMILESO=S(=O)(Nc1ccc(N2CCN(c3ccccn3)CC2)nn1)c1ccccc1
InChIInChI=1S/C19H20N6O2S/c26-28(27,16-6-2-1-3-7-16)23-17-9-10-19(22-21-17)25-14-12-24(13-15-25)18-8-4-5-11-20-18/h1-11H,12-15H2,(H,21,23)
InChIKeyVJCTXDRZTCJNBS-UHFFFAOYSA-N
MW396.48 g/mol
LogP2.00
Rot. Bonds5

About N-[6-(4-pyridin-2-ylpiperazin-1-yl)pyridazin-3-yl]benzenesulfonamide

N-[6-(4-pyridin-2-ylpiperazin-1-yl)pyridazin-3-yl]benzenesulfonamide (PubChem CID 113043896) has the molecular formula C19H20N6O2S and a molecular weight of 396.48 g/mol. Its IUPAC name is N-[6-(4-pyridin-2-ylpiperazin-1-yl)pyridazin-3-yl]benzenesulfonamide.

Molecular Properties

Compound NameN-[6-(4-pyridin-2-ylpiperazin-1-yl)pyridazin-3-yl]benzenesulfonamide
PubChem CID113043896
Molecular FormulaC19H20N6O2S
Molecular Weight396.48 g/mol
Exact Mass396.14
IUPAC NameN-[6-(4-pyridin-2-ylpiperazin-1-yl)pyridazin-3-yl]benzenesulfonamide
SMILESO=S(=O)(Nc1ccc(N2CCN(c3ccccn3)CC2)nn1)c1ccccc1
InChIInChI=1S/C19H20N6O2S/c26-28(27,16-6-2-1-3-7-16)23-17-9-10-19(22-21-17)25-14-12-24(13-15-25)18-8-4-5-11-20-18/h1-11H,12-15H2,(H,21,23)
InChIKeyVJCTXDRZTCJNBS-UHFFFAOYSA-N
XLogP2.00
TPSA91.32 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.48
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-[6-(4-pyridin-2-ylpiperazin-1-yl)pyridazin-3-yl]benzenesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(dimethylsulfamoylamino)-6-(4-pyridin-2-ylpiperazin-1-yl)pyridazine
CID 113043895
N-(6-morpholin-4-ylpyridazin-3-yl)benzenesulfonamide
CID 2999131
2-phenyl-N-[6-(4-pyridin-2-ylpiperazin-1-yl)pyridazin-3-yl]acetamide
CID 113043868
2-chloro-N-(6-piperidin-1-ylpyridazin-3-yl)benzenesulfonamide
CID 113039063
3-(dimethylsulfamoylamino)-6-(4-pyrimidin-2-ylpiperazin-1-yl)pyridazine
CID 113043949
4-ethoxy-N-(6-pyrrolidin-1-ylpyridazin-3-yl)benzenesulfonamide
CID 113038808
4-chloro-N-[6-(4-pyridin-2-ylpiperazin-1-yl)pyridazin-3-yl]benzamide
CID 113043874
4-methyl-N-[2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-5-yl]benzenesulfonamide
CID 121112921
N-[6-(3,4-dihydro-1H-isoquinolin-2-yl)pyridazin-3-yl]-4-fluorobenzenesulfonamide
CID 113042471
4-chloro-N-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]benzenesulfonamide
CID 113039262
4-cyclopentyloxy-N-(6-pyrrolidin-1-ylpyridazin-3-yl)benzenesulfonamide
CID 113038800
3-[4-(benzenesulfonyl)piperazin-1-yl]-6-pyrrolidin-1-ylpyridazine
CID 7287685

Frequently Asked Questions

What is the IUPAC name of N-[6-(4-pyridin-2-ylpiperazin-1-yl)pyridazin-3-yl]benzenesulfonamide?
The IUPAC name of N-[6-(4-pyridin-2-ylpiperazin-1-yl)pyridazin-3-yl]benzenesulfonamide (CID 113043896) is N-[6-(4-pyridin-2-ylpiperazin-1-yl)pyridazin-3-yl]benzenesulfonamide.
What is the SMILES notation for N-[6-(4-pyridin-2-ylpiperazin-1-yl)pyridazin-3-yl]benzenesulfonamide?
The canonical SMILES for N-[6-(4-pyridin-2-ylpiperazin-1-yl)pyridazin-3-yl]benzenesulfonamide is O=S(=O)(Nc1ccc(N2CCN(c3ccccn3)CC2)nn1)c1ccccc1.
What is the InChIKey of N-[6-(4-pyridin-2-ylpiperazin-1-yl)pyridazin-3-yl]benzenesulfonamide?
The InChIKey is VJCTXDRZTCJNBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N6O2S/c26-28(27,16-6-2-1-3-7-16)23-17-9-10-19(22-21-17)25-14-12-24(13-15-25)18-8-4-5-11-20-18/h1-11H,12-15H2,(H,21,23).
What are the key properties of N-[6-(4-pyridin-2-ylpiperazin-1-yl)pyridazin-3-yl]benzenesulfonamide?
N-[6-(4-pyridin-2-ylpiperazin-1-yl)pyridazin-3-yl]benzenesulfonamide has a molecular weight of 396.48 g/mol, XLogP of 2.00, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(4-pyridin-2-ylpiperazin-1-yl)pyridazin-3-yl]benzenesulfonamide is sourced from PubChem (CID 113043896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).