5-[(4-hydroxyphenyl)-phenylmethylidene]imidazolidine-2,4-dione

C16H12N2O3 — CID 139949029

IUPAC5-[(4-hydroxyphenyl)-phenylmethylidene]imidazolidine-2,4-dione
SMILESO=C1NC(=O)C(=C(c2ccccc2)c2ccc(O)cc2)N1
InChIInChI=1S/C16H12N2O3/c19-12-8-6-11(7-9-12)13(10-4-2-1-3-5-10)14-15(20)18-16(21)17-14/h1-9,19H,(H2,17,18,20,21)
InChIKeyTWARBOBFNWWDKW-UHFFFAOYSA-N
MW280.28 g/mol
LogP1.99
Rot. Bonds2

About 5-[(4-hydroxyphenyl)-phenylmethylidene]imidazolidine-2,4-dione

5-[(4-hydroxyphenyl)-phenylmethylidene]imidazolidine-2,4-dione (PubChem CID 139949029) has the molecular formula C16H12N2O3 and a molecular weight of 280.28 g/mol. Its IUPAC name is 5-[(4-hydroxyphenyl)-phenylmethylidene]imidazolidine-2,4-dione.

Molecular Properties

Compound Name5-[(4-hydroxyphenyl)-phenylmethylidene]imidazolidine-2,4-dione
PubChem CID139949029
Molecular FormulaC16H12N2O3
Molecular Weight280.28 g/mol
Exact Mass280.08
IUPAC Name5-[(4-hydroxyphenyl)-phenylmethylidene]imidazolidine-2,4-dione
SMILESO=C1NC(=O)C(=C(c2ccccc2)c2ccc(O)cc2)N1
InChIInChI=1S/C16H12N2O3/c19-12-8-6-11(7-9-12)13(10-4-2-1-3-5-10)14-15(20)18-16(21)17-14/h1-9,19H,(H2,17,18,20,21)
InChIKeyTWARBOBFNWWDKW-UHFFFAOYSA-N
XLogP1.99
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.28
LogP ≤ 51.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

(4E)-4-[(4-hydroxyphenyl)-phenylmethylidene]naphthalen-1-one
CID 10663747
(4-hydroxyphenyl)-phenylmethanone
CID 139062648
(5E)-5-[(4-hydroxyphenyl)methylidene]imidazolidine-2,4-dione
CID 727382
benzene-1,4-diol;benzoic acid
CID 67019242
isoindole-1,3-dione;phenol
CID 157178846
phenol;phosphane
CID 159689182
4-[cyclopropa[b]naphthalen-1-ylidene(phenyl)methyl]phenol
CID 11427189
butane;(4-hydroxyphenyl)-phenylmethanone
CID 70634619
molecular oxygen;phenol
CID 141080591
phenol;phosphane;zirconium
CID 162496766
phenol;trihydrochloride;hydrofluoride
CID 174750798
phenol;phosphane;trihydrochloride
CID 174862771

Frequently Asked Questions

What is the IUPAC name of 5-[(4-hydroxyphenyl)-phenylmethylidene]imidazolidine-2,4-dione?
The IUPAC name of 5-[(4-hydroxyphenyl)-phenylmethylidene]imidazolidine-2,4-dione (CID 139949029) is 5-[(4-hydroxyphenyl)-phenylmethylidene]imidazolidine-2,4-dione.
What is the SMILES notation for 5-[(4-hydroxyphenyl)-phenylmethylidene]imidazolidine-2,4-dione?
The canonical SMILES for 5-[(4-hydroxyphenyl)-phenylmethylidene]imidazolidine-2,4-dione is O=C1NC(=O)C(=C(c2ccccc2)c2ccc(O)cc2)N1.
What is the InChIKey of 5-[(4-hydroxyphenyl)-phenylmethylidene]imidazolidine-2,4-dione?
The InChIKey is TWARBOBFNWWDKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N2O3/c19-12-8-6-11(7-9-12)13(10-4-2-1-3-5-10)14-15(20)18-16(21)17-14/h1-9,19H,(H2,17,18,20,21).
What are the key properties of 5-[(4-hydroxyphenyl)-phenylmethylidene]imidazolidine-2,4-dione?
5-[(4-hydroxyphenyl)-phenylmethylidene]imidazolidine-2,4-dione has a molecular weight of 280.28 g/mol, XLogP of 1.99, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(4-hydroxyphenyl)-phenylmethylidene]imidazolidine-2,4-dione is sourced from PubChem (CID 139949029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).