3-[(2-bromophenyl)methyl]-5,5-diphenylimidazolidine-2,4-dione

C22H17BrN2O2 — CID 26018170

IUPAC3-[(2-bromophenyl)methyl]-5,5-diphenylimidazolidine-2,4-dione
SMILESO=C1NC(c2ccccc2)(c2ccccc2)C(=O)N1Cc1ccccc1Br
InChIInChI=1S/C22H17BrN2O2/c23-19-14-8-7-9-16(19)15-25-20(26)22(24-21(25)27,17-10-3-1-4-11-17)18-12-5-2-6-13-18/h1-14H,15H2,(H,24,27)
InChIKeyGYNGYRAYTFAVSK-UHFFFAOYSA-N
MW421.29 g/mol
LogP4.44
Rot. Bonds4

About 3-[(2-bromophenyl)methyl]-5,5-diphenylimidazolidine-2,4-dione

3-[(2-bromophenyl)methyl]-5,5-diphenylimidazolidine-2,4-dione (PubChem CID 26018170) has the molecular formula C22H17BrN2O2 and a molecular weight of 421.29 g/mol. Its IUPAC name is 3-[(2-bromophenyl)methyl]-5,5-diphenylimidazolidine-2,4-dione.

Molecular Properties

Compound Name3-[(2-bromophenyl)methyl]-5,5-diphenylimidazolidine-2,4-dione
PubChem CID26018170
Molecular FormulaC22H17BrN2O2
Molecular Weight421.29 g/mol
Exact Mass420.05
IUPAC Name3-[(2-bromophenyl)methyl]-5,5-diphenylimidazolidine-2,4-dione
SMILESO=C1NC(c2ccccc2)(c2ccccc2)C(=O)N1Cc1ccccc1Br
InChIInChI=1S/C22H17BrN2O2/c23-19-14-8-7-9-16(19)15-25-20(26)22(24-21(25)27,17-10-3-1-4-11-17)18-12-5-2-6-13-18/h1-14H,15H2,(H,24,27)
InChIKeyGYNGYRAYTFAVSK-UHFFFAOYSA-N
XLogP4.44
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500421.29
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-(naphthalen-1-ylmethyl)-5,5-diphenylimidazolidine-2,4-dione
CID 7916945
3-[(2,4-dichlorophenyl)methyl]-5,5-diphenylimidazolidine-2,4-dione
CID 4272734
3-[(4-methylphenyl)methyl]-5,5-diphenylimidazolidine-2,4-dione
CID 4810451
N-(2-bromophenyl)-2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)acetamide
CID 4045289
7-[(2-bromophenyl)methyl]-5,7-diazaspiro[2.5]octane-6,8-dione
CID 138012218
3-[(3,4-difluorophenyl)methyl]-5,5-diphenylimidazolidine-2,4-dione
CID 78797815
5,5-diphenyl-3-(3-sulfanylpropyl)imidazolidine-2,4-dione
CID 102066490
5,5-bis(4-methoxyphenyl)-3-(naphthalen-1-ylmethyl)imidazolidine-2,4-dione
CID 2090016
(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methoxy-oxophosphanium
CID 173376528
5,5-diphenyl-3-[2-(propan-2-ylamino)ethyl]imidazolidine-2,4-dione
CID 129132203
5,5-diphenyl-3-[(2-sulfanylidene-3H-1,3,4-oxadiazol-5-yl)methyl]imidazolidine-2,4-dione
CID 71574497
3-decyl-5,5-diphenylimidazolidine-2,4-dione
CID 11696827

Frequently Asked Questions

What is the IUPAC name of 3-[(2-bromophenyl)methyl]-5,5-diphenylimidazolidine-2,4-dione?
The IUPAC name of 3-[(2-bromophenyl)methyl]-5,5-diphenylimidazolidine-2,4-dione (CID 26018170) is 3-[(2-bromophenyl)methyl]-5,5-diphenylimidazolidine-2,4-dione.
What is the SMILES notation for 3-[(2-bromophenyl)methyl]-5,5-diphenylimidazolidine-2,4-dione?
The canonical SMILES for 3-[(2-bromophenyl)methyl]-5,5-diphenylimidazolidine-2,4-dione is O=C1NC(c2ccccc2)(c2ccccc2)C(=O)N1Cc1ccccc1Br.
What is the InChIKey of 3-[(2-bromophenyl)methyl]-5,5-diphenylimidazolidine-2,4-dione?
The InChIKey is GYNGYRAYTFAVSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17BrN2O2/c23-19-14-8-7-9-16(19)15-25-20(26)22(24-21(25)27,17-10-3-1-4-11-17)18-12-5-2-6-13-18/h1-14H,15H2,(H,24,27).
What are the key properties of 3-[(2-bromophenyl)methyl]-5,5-diphenylimidazolidine-2,4-dione?
3-[(2-bromophenyl)methyl]-5,5-diphenylimidazolidine-2,4-dione has a molecular weight of 421.29 g/mol, XLogP of 4.44, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-bromophenyl)methyl]-5,5-diphenylimidazolidine-2,4-dione is sourced from PubChem (CID 26018170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).