1,1'-biphenyl;5,5-diphenylimidazolidine-2,4-dione

C27H22N2O2 — CID 70574558

IUPAC1,1'-biphenyl;5,5-diphenylimidazolidine-2,4-dione
SMILESO=C1NC(=O)C(c2ccccc2)(c2ccccc2)N1.c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C15H12N2O2.C12H10/c18-13-15(17-14(19)16-13,11-7-3-1-4-8-11)12-9-5-2-6-10-12;1-3-7-11(8-4-1)12-9-5-2-6-10-12/h1-10H,(H2,16,17,18,19);1-10H
InChIKeyVXYDVUDDBBHQAA-UHFFFAOYSA-N
MW406.49 g/mol
LogP5.12
Rot. Bonds3

About 1,1'-biphenyl;5,5-diphenylimidazolidine-2,4-dione

1,1'-biphenyl;5,5-diphenylimidazolidine-2,4-dione (PubChem CID 70574558) has the molecular formula C27H22N2O2 and a molecular weight of 406.49 g/mol. Its IUPAC name is 1,1'-biphenyl;5,5-diphenylimidazolidine-2,4-dione.

Molecular Properties

Compound Name1,1'-biphenyl;5,5-diphenylimidazolidine-2,4-dione
PubChem CID70574558
Molecular FormulaC27H22N2O2
Molecular Weight406.49 g/mol
Exact Mass406.17
IUPAC Name1,1'-biphenyl;5,5-diphenylimidazolidine-2,4-dione
SMILESO=C1NC(=O)C(c2ccccc2)(c2ccccc2)N1.c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C15H12N2O2.C12H10/c18-13-15(17-14(19)16-13,11-7-3-1-4-8-11)12-9-5-2-6-10-12;1-3-7-11(8-4-1)12-9-5-2-6-10-12/h1-10H,(H2,16,17,18,19);1-10H
InChIKeyVXYDVUDDBBHQAA-UHFFFAOYSA-N
XLogP5.12
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500406.49
LogP ≤ 55.12
H-Bond Donors ≤ 52
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 1,1'-biphenyl;5,5-diphenylimidazolidine-2,4-dione?
The IUPAC name of 1,1'-biphenyl;5,5-diphenylimidazolidine-2,4-dione (CID 70574558) is 1,1'-biphenyl;5,5-diphenylimidazolidine-2,4-dione.
What is the SMILES notation for 1,1'-biphenyl;5,5-diphenylimidazolidine-2,4-dione?
The canonical SMILES for 1,1'-biphenyl;5,5-diphenylimidazolidine-2,4-dione is O=C1NC(=O)C(c2ccccc2)(c2ccccc2)N1.c1ccc(-c2ccccc2)cc1.
What is the InChIKey of 1,1'-biphenyl;5,5-diphenylimidazolidine-2,4-dione?
The InChIKey is VXYDVUDDBBHQAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O2.C12H10/c18-13-15(17-14(19)16-13,11-7-3-1-4-8-11)12-9-5-2-6-10-12;1-3-7-11(8-4-1)12-9-5-2-6-10-12/h1-10H,(H2,16,17,18,19);1-10H.
What are the key properties of 1,1'-biphenyl;5,5-diphenylimidazolidine-2,4-dione?
1,1'-biphenyl;5,5-diphenylimidazolidine-2,4-dione has a molecular weight of 406.49 g/mol, XLogP of 5.12, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1'-biphenyl;5,5-diphenylimidazolidine-2,4-dione is sourced from PubChem (CID 70574558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).