2-(4-methylphenyl)sulfonylpyridazin-3-one

C11H10N2O3S — CID 144748375

IUPAC2-(4-methylphenyl)sulfonylpyridazin-3-one
SMILESCc1ccc(S(=O)(=O)n2ncccc2=O)cc1
InChIInChI=1S/C11H10N2O3S/c1-9-4-6-10(7-5-9)17(15,16)13-11(14)3-2-8-12-13/h2-8H,1H3
InChIKeyDMRBMFGNWOKWPG-UHFFFAOYSA-N
MW250.28 g/mol
LogP0.79
Rot. Bonds2

About 2-(4-methylphenyl)sulfonylpyridazin-3-one

2-(4-methylphenyl)sulfonylpyridazin-3-one (PubChem CID 144748375) has the molecular formula C11H10N2O3S and a molecular weight of 250.28 g/mol. Its IUPAC name is 2-(4-methylphenyl)sulfonylpyridazin-3-one.

Molecular Properties

Compound Name2-(4-methylphenyl)sulfonylpyridazin-3-one
PubChem CID144748375
Molecular FormulaC11H10N2O3S
Molecular Weight250.28 g/mol
Exact Mass250.04
IUPAC Name2-(4-methylphenyl)sulfonylpyridazin-3-one
SMILESCc1ccc(S(=O)(=O)n2ncccc2=O)cc1
InChIInChI=1S/C11H10N2O3S/c1-9-4-6-10(7-5-9)17(15,16)13-11(14)3-2-8-12-13/h2-8H,1H3
InChIKeyDMRBMFGNWOKWPG-UHFFFAOYSA-N
XLogP0.79
TPSA69.03 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.28
LogP ≤ 50.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-(4-methylphenyl)sulfonylpyridazin-3-one 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

2-(4-methylphenyl)sulfonyl-6-phenylpyridazin-3-one
CID 13482071
methyl 2-(4-methylphenyl)sulfonylpyrazole-3-carboxylate
CID 15932793
4-methyl-N-[3-(6-oxopyridazin-1-yl)propyl]benzenesulfonamide
CID 30948657
1,4-bis-(4-methylphenyl)sulfonyl-1,4-diazocine
CID 12641448
2-(4-methylphenyl)-1-(4-methylphenyl)sulfonylimidazole
CID 110537991
3,6,9-tris-(4-methylphenyl)sulfonyl-3,6,9-triazatetracyclo[6.1.0.02,4.05,7]nonane
CID 12599628
1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridine
CID 69081244
(2-oxo-1-pyridinyl) 4-methylbenzenesulfonate
CID 19099974
2,3-dimethyl-1-(4-methylphenyl)sulfonylaziridine
CID 11218386
2-methyl-1-(4-methylphenyl)sulfonylpyrrole
CID 839845
azane;1-(4-methylphenyl)sulfonylimidazole
CID 174813676
2-(4-methylphenyl)sulfonyl-5-phenyl-4H-1,2,4-triazol-3-one
CID 135494515

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylphenyl)sulfonylpyridazin-3-one?
The IUPAC name of 2-(4-methylphenyl)sulfonylpyridazin-3-one (CID 144748375) is 2-(4-methylphenyl)sulfonylpyridazin-3-one.
What is the SMILES notation for 2-(4-methylphenyl)sulfonylpyridazin-3-one?
The canonical SMILES for 2-(4-methylphenyl)sulfonylpyridazin-3-one is Cc1ccc(S(=O)(=O)n2ncccc2=O)cc1.
What is the InChIKey of 2-(4-methylphenyl)sulfonylpyridazin-3-one?
The InChIKey is DMRBMFGNWOKWPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O3S/c1-9-4-6-10(7-5-9)17(15,16)13-11(14)3-2-8-12-13/h2-8H,1H3.
What are the key properties of 2-(4-methylphenyl)sulfonylpyridazin-3-one?
2-(4-methylphenyl)sulfonylpyridazin-3-one has a molecular weight of 250.28 g/mol, XLogP of 0.79, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylphenyl)sulfonylpyridazin-3-one is sourced from PubChem (CID 144748375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).