1-(2,4-dibromophenyl)imidazolidine-2,4-dione

C9H6Br2N2O2 — CID 79777774

IUPAC1-(2,4-dibromophenyl)imidazolidine-2,4-dione
SMILESO=C1CN(c2ccc(Br)cc2Br)C(=O)N1
InChIInChI=1S/C9H6Br2N2O2/c10-5-1-2-7(6(11)3-5)13-4-8(14)12-9(13)15/h1-3H,4H2,(H,12,14,15)
InChIKeyNCVBNODXNJZNAZ-UHFFFAOYSA-N
MW333.97 g/mol
LogP2.27
Rot. Bonds1

About 1-(2,4-dibromophenyl)imidazolidine-2,4-dione

1-(2,4-dibromophenyl)imidazolidine-2,4-dione (PubChem CID 79777774) has the molecular formula C9H6Br2N2O2 and a molecular weight of 333.97 g/mol. Its IUPAC name is 1-(2,4-dibromophenyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name1-(2,4-dibromophenyl)imidazolidine-2,4-dione
PubChem CID79777774
Molecular FormulaC9H6Br2N2O2
Molecular Weight333.97 g/mol
Exact Mass331.88
IUPAC Name1-(2,4-dibromophenyl)imidazolidine-2,4-dione
SMILESO=C1CN(c2ccc(Br)cc2Br)C(=O)N1
InChIInChI=1S/C9H6Br2N2O2/c10-5-1-2-7(6(11)3-5)13-4-8(14)12-9(13)15/h1-3H,4H2,(H,12,14,15)
InChIKeyNCVBNODXNJZNAZ-UHFFFAOYSA-N
XLogP2.27
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.97
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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-(2,4-dibromophenyl)imidazolidine-2,4-dione?
The IUPAC name of 1-(2,4-dibromophenyl)imidazolidine-2,4-dione (CID 79777774) is 1-(2,4-dibromophenyl)imidazolidine-2,4-dione.
What is the SMILES notation for 1-(2,4-dibromophenyl)imidazolidine-2,4-dione?
The canonical SMILES for 1-(2,4-dibromophenyl)imidazolidine-2,4-dione is O=C1CN(c2ccc(Br)cc2Br)C(=O)N1.
What is the InChIKey of 1-(2,4-dibromophenyl)imidazolidine-2,4-dione?
The InChIKey is NCVBNODXNJZNAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6Br2N2O2/c10-5-1-2-7(6(11)3-5)13-4-8(14)12-9(13)15/h1-3H,4H2,(H,12,14,15).
What are the key properties of 1-(2,4-dibromophenyl)imidazolidine-2,4-dione?
1-(2,4-dibromophenyl)imidazolidine-2,4-dione has a molecular weight of 333.97 g/mol, XLogP of 2.27, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dibromophenyl)imidazolidine-2,4-dione is sourced from PubChem (CID 79777774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).