1-(3,4-dimethylphenyl)-3-(3,4-dimethylphenyl)sulfonylimidazolidine-2,4-dione

C19H20N2O4S — CID 10499538

IUPAC1-(3,4-dimethylphenyl)-3-(3,4-dimethylphenyl)sulfonylimidazolidine-2,4-dione
SMILESCc1ccc(N2CC(=O)N(S(=O)(=O)c3ccc(C)c(C)c3)C2=O)cc1C
InChIInChI=1S/C19H20N2O4S/c1-12-5-7-16(9-14(12)3)20-11-18(22)21(19(20)23)26(24,25)17-8-6-13(2)15(4)10-17/h5-10H,11H2,1-4H3
InChIKeyRHYKGYBIOCNWTQ-UHFFFAOYSA-N
MW372.45 g/mol
LogP3.08
Rot. Bonds3

About 1-(3,4-dimethylphenyl)-3-(3,4-dimethylphenyl)sulfonylimidazolidine-2,4-dione

1-(3,4-dimethylphenyl)-3-(3,4-dimethylphenyl)sulfonylimidazolidine-2,4-dione (PubChem CID 10499538) has the molecular formula C19H20N2O4S and a molecular weight of 372.45 g/mol. Its IUPAC name is 1-(3,4-dimethylphenyl)-3-(3,4-dimethylphenyl)sulfonylimidazolidine-2,4-dione.

Molecular Properties

Compound Name1-(3,4-dimethylphenyl)-3-(3,4-dimethylphenyl)sulfonylimidazolidine-2,4-dione
PubChem CID10499538
Molecular FormulaC19H20N2O4S
Molecular Weight372.45 g/mol
Exact Mass372.11
IUPAC Name1-(3,4-dimethylphenyl)-3-(3,4-dimethylphenyl)sulfonylimidazolidine-2,4-dione
SMILESCc1ccc(N2CC(=O)N(S(=O)(=O)c3ccc(C)c(C)c3)C2=O)cc1C
InChIInChI=1S/C19H20N2O4S/c1-12-5-7-16(9-14(12)3)20-11-18(22)21(19(20)23)26(24,25)17-8-6-13(2)15(4)10-17/h5-10H,11H2,1-4H3
InChIKeyRHYKGYBIOCNWTQ-UHFFFAOYSA-N
XLogP3.08
TPSA74.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.45
LogP ≤ 53.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-(3,4-dimethylphenyl)-3-(3,4-dimethylphenyl)sulfonylimidazolidine-2,4-dione?
The IUPAC name of 1-(3,4-dimethylphenyl)-3-(3,4-dimethylphenyl)sulfonylimidazolidine-2,4-dione (CID 10499538) is 1-(3,4-dimethylphenyl)-3-(3,4-dimethylphenyl)sulfonylimidazolidine-2,4-dione.
What is the SMILES notation for 1-(3,4-dimethylphenyl)-3-(3,4-dimethylphenyl)sulfonylimidazolidine-2,4-dione?
The canonical SMILES for 1-(3,4-dimethylphenyl)-3-(3,4-dimethylphenyl)sulfonylimidazolidine-2,4-dione is Cc1ccc(N2CC(=O)N(S(=O)(=O)c3ccc(C)c(C)c3)C2=O)cc1C.
What is the InChIKey of 1-(3,4-dimethylphenyl)-3-(3,4-dimethylphenyl)sulfonylimidazolidine-2,4-dione?
The InChIKey is RHYKGYBIOCNWTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O4S/c1-12-5-7-16(9-14(12)3)20-11-18(22)21(19(20)23)26(24,25)17-8-6-13(2)15(4)10-17/h5-10H,11H2,1-4H3.
What are the key properties of 1-(3,4-dimethylphenyl)-3-(3,4-dimethylphenyl)sulfonylimidazolidine-2,4-dione?
1-(3,4-dimethylphenyl)-3-(3,4-dimethylphenyl)sulfonylimidazolidine-2,4-dione has a molecular weight of 372.45 g/mol, XLogP of 3.08, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,4-dimethylphenyl)-3-(3,4-dimethylphenyl)sulfonylimidazolidine-2,4-dione is sourced from PubChem (CID 10499538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).