4-(4-methylphenyl)-1-(4-methylphenyl)sulfonyl-2,3-dihydropyridin-6-one

C19H19NO3S — CID 164898045

IUPAC4-(4-methylphenyl)-1-(4-methylphenyl)sulfonyl-2,3-dihydropyridin-6-one
SMILESCc1ccc(C2=CC(=O)N(S(=O)(=O)c3ccc(C)cc3)CC2)cc1
InChIInChI=1S/C19H19NO3S/c1-14-3-7-16(8-4-14)17-11-12-20(19(21)13-17)24(22,23)18-9-5-15(2)6-10-18/h3-10,13H,11-12H2,1-2H3
InChIKeyJQYUYPHLODHFSC-UHFFFAOYSA-N
MW341.43 g/mol
LogP3.31
Rot. Bonds3

About 4-(4-methylphenyl)-1-(4-methylphenyl)sulfonyl-2,3-dihydropyridin-6-one

4-(4-methylphenyl)-1-(4-methylphenyl)sulfonyl-2,3-dihydropyridin-6-one (PubChem CID 164898045) has the molecular formula C19H19NO3S and a molecular weight of 341.43 g/mol. Its IUPAC name is 4-(4-methylphenyl)-1-(4-methylphenyl)sulfonyl-2,3-dihydropyridin-6-one.

Molecular Properties

Compound Name4-(4-methylphenyl)-1-(4-methylphenyl)sulfonyl-2,3-dihydropyridin-6-one
PubChem CID164898045
Molecular FormulaC19H19NO3S
Molecular Weight341.43 g/mol
Exact Mass341.11
IUPAC Name4-(4-methylphenyl)-1-(4-methylphenyl)sulfonyl-2,3-dihydropyridin-6-one
SMILESCc1ccc(C2=CC(=O)N(S(=O)(=O)c3ccc(C)cc3)CC2)cc1
InChIInChI=1S/C19H19NO3S/c1-14-3-7-16(8-4-14)17-11-12-20(19(21)13-17)24(22,23)18-9-5-15(2)6-10-18/h3-10,13H,11-12H2,1-2H3
InChIKeyJQYUYPHLODHFSC-UHFFFAOYSA-N
XLogP3.31
TPSA54.45 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.43
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-(4-methylphenyl)-1-(4-methylphenyl)sulfonyl-2,3-dihydropyridin-6-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

1-(4-methylphenyl)sulfonyl-4-thiophen-2-yl-2,3-dihydropyridin-6-one
CID 164898018
3-methylidene-1-(4-methylphenyl)sulfonylpyrrolidin-2-one
CID 10956008
2-(4-methylphenyl)sulfonyl-3,4-dihydroisoquinolin-1-one
CID 11472135
1-(4-methylphenyl)sulfonyl-2-propan-2-ylideneazetidine
CID 101424960
1,4-bis-(4-methylphenyl)sulfonyl-3,5,6,7-tetrahydro-2H-pyrrolo[3,2-b]pyridine
CID 101444934
1-(4-methylphenyl)sulfonyl-3-phenyl-2H-quinoline
CID 175302706
1-(4-methylphenyl)sulfonyl-2-phenyl-4,5-dihydroimidazole
CID 34885089
1-(4-methylphenyl)sulfonyl-4-trimethylsilyl-2,3-dihydrocyclopenta[b]pyrrol-5-one
CID 101058095
(4Z)-4-(hydroxymethylidene)-1-(4-methylphenyl)sulfonyl-2,3-dihydro-1-benzazepin-5-one
CID 44723400
1-(4-methylphenyl)sulfonyl-5-phenyl-2,3,4,7-tetrahydroazepine
CID 25193145
4-methyl-3-(4-methylphenyl)sulfonyl-1,2-dihydropyrrolo[2,3-b]indole
CID 134957407
1-(2-bromophenyl)sulfonyl-3-(4-methylphenyl)sulfonylimidazolidin-2-one
CID 44602022

Frequently Asked Questions

What is the IUPAC name of 4-(4-methylphenyl)-1-(4-methylphenyl)sulfonyl-2,3-dihydropyridin-6-one?
The IUPAC name of 4-(4-methylphenyl)-1-(4-methylphenyl)sulfonyl-2,3-dihydropyridin-6-one (CID 164898045) is 4-(4-methylphenyl)-1-(4-methylphenyl)sulfonyl-2,3-dihydropyridin-6-one.
What is the SMILES notation for 4-(4-methylphenyl)-1-(4-methylphenyl)sulfonyl-2,3-dihydropyridin-6-one?
The canonical SMILES for 4-(4-methylphenyl)-1-(4-methylphenyl)sulfonyl-2,3-dihydropyridin-6-one is Cc1ccc(C2=CC(=O)N(S(=O)(=O)c3ccc(C)cc3)CC2)cc1.
What is the InChIKey of 4-(4-methylphenyl)-1-(4-methylphenyl)sulfonyl-2,3-dihydropyridin-6-one?
The InChIKey is JQYUYPHLODHFSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19NO3S/c1-14-3-7-16(8-4-14)17-11-12-20(19(21)13-17)24(22,23)18-9-5-15(2)6-10-18/h3-10,13H,11-12H2,1-2H3.
What are the key properties of 4-(4-methylphenyl)-1-(4-methylphenyl)sulfonyl-2,3-dihydropyridin-6-one?
4-(4-methylphenyl)-1-(4-methylphenyl)sulfonyl-2,3-dihydropyridin-6-one has a molecular weight of 341.43 g/mol, XLogP of 3.31, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methylphenyl)-1-(4-methylphenyl)sulfonyl-2,3-dihydropyridin-6-one is sourced from PubChem (CID 164898045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).