3-[(E)-(2-hydroxyphenyl)methylideneamino]-5,5-diphenylimidazolidine-2,4-dione

C22H17N3O3 — CID 135788061

IUPAC3-[(E)-(2-hydroxyphenyl)methylideneamino]-5,5-diphenylimidazolidine-2,4-dione
SMILESO=C1NC(c2ccccc2)(c2ccccc2)C(=O)N1/N=C/c1ccccc1O
InChIInChI=1S/C22H17N3O3/c26-19-14-8-7-9-16(19)15-23-25-20(27)22(24-21(25)28,17-10-3-1-4-11-17)18-12-5-2-6-13-18/h1-15,26H,(H,24,28)/b23-15+
InChIKeyKSZYGRVDLZXMAI-HZHRSRAPSA-N
MW371.40 g/mol
LogP3.22
Rot. Bonds4

About 3-[(E)-(2-hydroxyphenyl)methylideneamino]-5,5-diphenylimidazolidine-2,4-dione

3-[(E)-(2-hydroxyphenyl)methylideneamino]-5,5-diphenylimidazolidine-2,4-dione (PubChem CID 135788061) has the molecular formula C22H17N3O3 and a molecular weight of 371.40 g/mol. Its IUPAC name is 3-[(E)-(2-hydroxyphenyl)methylideneamino]-5,5-diphenylimidazolidine-2,4-dione.

Molecular Properties

Compound Name3-[(E)-(2-hydroxyphenyl)methylideneamino]-5,5-diphenylimidazolidine-2,4-dione
PubChem CID135788061
Molecular FormulaC22H17N3O3
Molecular Weight371.40 g/mol
Exact Mass371.13
IUPAC Name3-[(E)-(2-hydroxyphenyl)methylideneamino]-5,5-diphenylimidazolidine-2,4-dione
SMILESO=C1NC(c2ccccc2)(c2ccccc2)C(=O)N1/N=C/c1ccccc1O
InChIInChI=1S/C22H17N3O3/c26-19-14-8-7-9-16(19)15-23-25-20(27)22(24-21(25)28,17-10-3-1-4-11-17)18-12-5-2-6-13-18/h1-15,26H,(H,24,28)/b23-15+
InChIKeyKSZYGRVDLZXMAI-HZHRSRAPSA-N
XLogP3.22
TPSA82.00 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.40
LogP ≤ 53.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_A(479)', 'substructure': 'N/A'}, {'alert_name': 'hydantoin', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

3-[(Z)-(3,5-dimethoxyphenyl)methylideneamino]-5,5-diphenylimidazolidine-2,4-dione
CID 9349596
4-[(Z)-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)iminomethyl]-1,5-dimethylpyrrole-2-carbonitrile
CID 9349588
3-[(E)-[4-(dimethylamino)-3-fluorophenyl]methylideneamino]-5,5-diphenylimidazolidine-2,4-dione
CID 166187584
(5R)-3-[(E)-(2-hydroxy-4-propoxyphenyl)methylideneamino]-5-methyl-5-phenylimidazolidine-2,4-dione
CID 135673713
(5S)-3-[(E)-(4-hydroxyphenyl)methylideneamino]-5-methyl-5-phenylimidazolidine-2,4-dione
CID 135673695
(1R,2R,6S,7S)-4-[(Z)-(2-hydroxyphenyl)methylideneamino]spiro[4-azatricyclo[5.2.1.02,6]dec-8-ene-10,1'-cyclopropane]-3,5-dione
CID 136663089
(5R)-3-[(E)-(3,4-dihydroxyphenyl)methylideneamino]-5-ethyl-5-phenylimidazolidine-2,4-dione
CID 135800304
(5S)-3-[(E)-(2,3-dihydroxyphenyl)methylideneamino]-5-(4-methoxyphenyl)-5-methylimidazolidine-2,4-dione
CID 135562562
3-[(E)-(2-hydroxyphenyl)methylideneamino]-1,3-thiazolidine-2,4-dione
CID 135776448
(5R)-3-[(Z)-(2,3-dimethoxyphenyl)methylideneamino]-5-ethyl-5-phenylimidazolidine-2,4-dione
CID 9296516
3-benzoyl-5,5-diphenylimidazolidine-2,4-dione
CID 101453416
(5S)-3-[(5-bromo-2-hydroxyphenyl)methylideneamino]-5-ethyl-5-methylimidazolidine-2,4-dione
CID 2644130

Frequently Asked Questions

What is the IUPAC name of 3-[(E)-(2-hydroxyphenyl)methylideneamino]-5,5-diphenylimidazolidine-2,4-dione?
The IUPAC name of 3-[(E)-(2-hydroxyphenyl)methylideneamino]-5,5-diphenylimidazolidine-2,4-dione (CID 135788061) is 3-[(E)-(2-hydroxyphenyl)methylideneamino]-5,5-diphenylimidazolidine-2,4-dione.
What is the SMILES notation for 3-[(E)-(2-hydroxyphenyl)methylideneamino]-5,5-diphenylimidazolidine-2,4-dione?
The canonical SMILES for 3-[(E)-(2-hydroxyphenyl)methylideneamino]-5,5-diphenylimidazolidine-2,4-dione is O=C1NC(c2ccccc2)(c2ccccc2)C(=O)N1/N=C/c1ccccc1O.
What is the InChIKey of 3-[(E)-(2-hydroxyphenyl)methylideneamino]-5,5-diphenylimidazolidine-2,4-dione?
The InChIKey is KSZYGRVDLZXMAI-HZHRSRAPSA-N. The full InChI is InChI=1S/C22H17N3O3/c26-19-14-8-7-9-16(19)15-23-25-20(27)22(24-21(25)28,17-10-3-1-4-11-17)18-12-5-2-6-13-18/h1-15,26H,(H,24,28)/b23-15+.
What are the key properties of 3-[(E)-(2-hydroxyphenyl)methylideneamino]-5,5-diphenylimidazolidine-2,4-dione?
3-[(E)-(2-hydroxyphenyl)methylideneamino]-5,5-diphenylimidazolidine-2,4-dione has a molecular weight of 371.40 g/mol, XLogP of 3.22, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(E)-(2-hydroxyphenyl)methylideneamino]-5,5-diphenylimidazolidine-2,4-dione is sourced from PubChem (CID 135788061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).