1,3-bis(4-bromophenyl)-5-phenylimidazolidine-2,4-dione

C21H14Br2N2O2 — CID 11851013

IUPAC1,3-bis(4-bromophenyl)-5-phenylimidazolidine-2,4-dione
SMILESO=C1C(c2ccccc2)N(c2ccc(Br)cc2)C(=O)N1c1ccc(Br)cc1
InChIInChI=1S/C21H14Br2N2O2/c22-15-6-10-17(11-7-15)24-19(14-4-2-1-3-5-14)20(26)25(21(24)27)18-12-8-16(23)9-13-18/h1-13,19H
InChIKeyROASQEPZAKGACK-UHFFFAOYSA-N
MW486.16 g/mol
LogP5.93
Rot. Bonds3

About 1,3-bis(4-bromophenyl)-5-phenylimidazolidine-2,4-dione

1,3-bis(4-bromophenyl)-5-phenylimidazolidine-2,4-dione (PubChem CID 11851013) has the molecular formula C21H14Br2N2O2 and a molecular weight of 486.16 g/mol. Its IUPAC name is 1,3-bis(4-bromophenyl)-5-phenylimidazolidine-2,4-dione.

Molecular Properties

Compound Name1,3-bis(4-bromophenyl)-5-phenylimidazolidine-2,4-dione
PubChem CID11851013
Molecular FormulaC21H14Br2N2O2
Molecular Weight486.16 g/mol
Exact Mass483.94
IUPAC Name1,3-bis(4-bromophenyl)-5-phenylimidazolidine-2,4-dione
SMILESO=C1C(c2ccccc2)N(c2ccc(Br)cc2)C(=O)N1c1ccc(Br)cc1
InChIInChI=1S/C21H14Br2N2O2/c22-15-6-10-17(11-7-15)24-19(14-4-2-1-3-5-14)20(26)25(21(24)27)18-12-8-16(23)9-13-18/h1-13,19H
InChIKeyROASQEPZAKGACK-UHFFFAOYSA-N
XLogP5.93
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500486.16
LogP ≤ 55.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 1,3-bis(4-bromophenyl)-5-phenylimidazolidine-2,4-dione with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1,3-bis(4-bromophenyl)-5-phenylimidazolidine-2,4-dione?
The IUPAC name of 1,3-bis(4-bromophenyl)-5-phenylimidazolidine-2,4-dione (CID 11851013) is 1,3-bis(4-bromophenyl)-5-phenylimidazolidine-2,4-dione.
What is the SMILES notation for 1,3-bis(4-bromophenyl)-5-phenylimidazolidine-2,4-dione?
The canonical SMILES for 1,3-bis(4-bromophenyl)-5-phenylimidazolidine-2,4-dione is O=C1C(c2ccccc2)N(c2ccc(Br)cc2)C(=O)N1c1ccc(Br)cc1.
What is the InChIKey of 1,3-bis(4-bromophenyl)-5-phenylimidazolidine-2,4-dione?
The InChIKey is ROASQEPZAKGACK-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H14Br2N2O2/c22-15-6-10-17(11-7-15)24-19(14-4-2-1-3-5-14)20(26)25(21(24)27)18-12-8-16(23)9-13-18/h1-13,19H.
What are the key properties of 1,3-bis(4-bromophenyl)-5-phenylimidazolidine-2,4-dione?
1,3-bis(4-bromophenyl)-5-phenylimidazolidine-2,4-dione has a molecular weight of 486.16 g/mol, XLogP of 5.93, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-bis(4-bromophenyl)-5-phenylimidazolidine-2,4-dione is sourced from PubChem (CID 11851013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).