3-(3,4-dimethoxyphenyl)sulfonyl-1-(3,4-dimethylphenyl)imidazolidine-2,4-dione

C19H20N2O6S — CID 10431323

IUPAC3-(3,4-dimethoxyphenyl)sulfonyl-1-(3,4-dimethylphenyl)imidazolidine-2,4-dione
SMILESCOc1ccc(S(=O)(=O)N2C(=O)CN(c3ccc(C)c(C)c3)C2=O)cc1OC
InChIInChI=1S/C19H20N2O6S/c1-12-5-6-14(9-13(12)2)20-11-18(22)21(19(20)23)28(24,25)15-7-8-16(26-3)17(10-15)27-4/h5-10H,11H2,1-4H3
InChIKeyKLKUYQFIUYGVGO-UHFFFAOYSA-N
MW404.44 g/mol
LogP2.48
Rot. Bonds5

About 3-(3,4-dimethoxyphenyl)sulfonyl-1-(3,4-dimethylphenyl)imidazolidine-2,4-dione

3-(3,4-dimethoxyphenyl)sulfonyl-1-(3,4-dimethylphenyl)imidazolidine-2,4-dione (PubChem CID 10431323) has the molecular formula C19H20N2O6S and a molecular weight of 404.44 g/mol. Its IUPAC name is 3-(3,4-dimethoxyphenyl)sulfonyl-1-(3,4-dimethylphenyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name3-(3,4-dimethoxyphenyl)sulfonyl-1-(3,4-dimethylphenyl)imidazolidine-2,4-dione
PubChem CID10431323
Molecular FormulaC19H20N2O6S
Molecular Weight404.44 g/mol
Exact Mass404.10
IUPAC Name3-(3,4-dimethoxyphenyl)sulfonyl-1-(3,4-dimethylphenyl)imidazolidine-2,4-dione
SMILESCOc1ccc(S(=O)(=O)N2C(=O)CN(c3ccc(C)c(C)c3)C2=O)cc1OC
InChIInChI=1S/C19H20N2O6S/c1-12-5-6-14(9-13(12)2)20-11-18(22)21(19(20)23)28(24,25)15-7-8-16(26-3)17(10-15)27-4/h5-10H,11H2,1-4H3
InChIKeyKLKUYQFIUYGVGO-UHFFFAOYSA-N
XLogP2.48
TPSA93.22 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.44
LogP ≤ 52.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

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Related Compounds

N-(3,4-Dimethylphenyl)-2-[N-(2-phenylethyl)3,4-dimethoxybenzenesulfonamido]acetamide
CID 1208429
3-(4-Methoxy-benzenesulfonyl)-1-phenyl-imidazolidine-2,4-dione
CID 10545533
3-(3,4-Dimethoxy-benzenesulfonyl)-1-phenyl-imidazolidine-2,4-dione
CID 10714544
3-(3-Methoxy-benzenesulfonyl)-1-phenyl-imidazolidine-2,4-dione
CID 10736348
1-(4-Methoxyphenyl)sulfonyl-3-[4-(trifluoromethyl)phenyl]imidazolidin-2-one
CID 137443819
N~2~-[(3,4-dimethoxyphenyl)sulfonyl]-N~2~-methyl-N~1~-(4-methylphenyl)glycinamide
CID 1316104
2-(3,4-dimethoxy-N-p-tolylphenylsulfonamido)-N,N-diethylacetamide
CID 3119056
N-(3,5-Dimethylphenyl)-2-[N-(2-phenylethyl)3,4-dimethoxybenzenesulfonamido]acetamide
CID 15991149
N,N-diethyl-2-(4-methoxy-N-p-tolylphenylsulfonamido)acetamide
CID 15993497
2-[4-(3,4-Dimethoxyphenyl)sulfonylpiperazin-1-yl]-1-(2-methyl-2,3-dihydroindol-1-yl)ethanone
CID 16328500
N-(1-(3,4-dimethylphenyl)-5-oxopyrrolidin-3-yl)-4-methoxybenzenesulfonamide
CID 16822409
2-(N-(2-cyano-4-methylphenyl)-3,4-dimethoxyphenylsulfonamido)-N,N-diethylacetamide
CID 44580865

Frequently Asked Questions

What is the IUPAC name of 3-(3,4-dimethoxyphenyl)sulfonyl-1-(3,4-dimethylphenyl)imidazolidine-2,4-dione?
The IUPAC name of 3-(3,4-dimethoxyphenyl)sulfonyl-1-(3,4-dimethylphenyl)imidazolidine-2,4-dione (CID 10431323) is 3-(3,4-dimethoxyphenyl)sulfonyl-1-(3,4-dimethylphenyl)imidazolidine-2,4-dione.
What is the SMILES notation for 3-(3,4-dimethoxyphenyl)sulfonyl-1-(3,4-dimethylphenyl)imidazolidine-2,4-dione?
The canonical SMILES for 3-(3,4-dimethoxyphenyl)sulfonyl-1-(3,4-dimethylphenyl)imidazolidine-2,4-dione is COc1ccc(S(=O)(=O)N2C(=O)CN(c3ccc(C)c(C)c3)C2=O)cc1OC.
What is the InChIKey of 3-(3,4-dimethoxyphenyl)sulfonyl-1-(3,4-dimethylphenyl)imidazolidine-2,4-dione?
The InChIKey is KLKUYQFIUYGVGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O6S/c1-12-5-6-14(9-13(12)2)20-11-18(22)21(19(20)23)28(24,25)15-7-8-16(26-3)17(10-15)27-4/h5-10H,11H2,1-4H3.
What are the key properties of 3-(3,4-dimethoxyphenyl)sulfonyl-1-(3,4-dimethylphenyl)imidazolidine-2,4-dione?
3-(3,4-dimethoxyphenyl)sulfonyl-1-(3,4-dimethylphenyl)imidazolidine-2,4-dione has a molecular weight of 404.44 g/mol, XLogP of 2.48, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,4-dimethoxyphenyl)sulfonyl-1-(3,4-dimethylphenyl)imidazolidine-2,4-dione is sourced from PubChem (CID 10431323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).