5-[(3,5-dibromo-4-hydroxyphenyl)methylidene]imidazolidine-2,4-dione

C10H6Br2N2O3 — CID 78472496

IUPAC5-[(3,5-dibromo-4-hydroxyphenyl)methylidene]imidazolidine-2,4-dione
SMILESO=C1NC(=O)C(=Cc2cc(Br)c(O)c(Br)c2)N1
InChIInChI=1S/C10H6Br2N2O3/c11-5-1-4(2-6(12)8(5)15)3-7-9(16)14-10(17)13-7/h1-3,15H,(H2,13,14,16,17)
InChIKeyYKWXNFDWIXFYKS-UHFFFAOYSA-N
MW361.98 g/mol
LogP2.10
Rot. Bonds1

About 5-[(3,5-dibromo-4-hydroxyphenyl)methylidene]imidazolidine-2,4-dione

5-[(3,5-dibromo-4-hydroxyphenyl)methylidene]imidazolidine-2,4-dione (PubChem CID 78472496) has the molecular formula C10H6Br2N2O3 and a molecular weight of 361.98 g/mol. Its IUPAC name is 5-[(3,5-dibromo-4-hydroxyphenyl)methylidene]imidazolidine-2,4-dione.

Molecular Properties

Compound Name5-[(3,5-dibromo-4-hydroxyphenyl)methylidene]imidazolidine-2,4-dione
PubChem CID78472496
Molecular FormulaC10H6Br2N2O3
Molecular Weight361.98 g/mol
Exact Mass359.87
IUPAC Name5-[(3,5-dibromo-4-hydroxyphenyl)methylidene]imidazolidine-2,4-dione
SMILESO=C1NC(=O)C(=Cc2cc(Br)c(O)c(Br)c2)N1
InChIInChI=1S/C10H6Br2N2O3/c11-5-1-4(2-6(12)8(5)15)3-7-9(16)14-10(17)13-7/h1-3,15H,(H2,13,14,16,17)
InChIKeyYKWXNFDWIXFYKS-UHFFFAOYSA-N
XLogP2.10
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.98
LogP ≤ 52.10
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

(5Z)-5-[(3-bromo-5-chloro-4-hydroxyphenyl)methylidene]imidazolidine-2,4-dione
CID 2287272
5-[(3-bromo-5-ethoxy-4-hydroxyphenyl)methylidene]imidazolidine-2,4-dione
CID 3938732
5-[(3-bromo-4-hydroxy-5-iodophenyl)methylidene]-2-sulfanylideneimidazolidin-4-one
CID 2880632
(5Z)-5-[(3-bromo-5-chloro-4-methoxyphenyl)methylidene]imidazolidine-2,4-dione
CID 21215971
(5E)-5-[(4-hydroxyphenyl)methylidene]imidazolidine-2,4-dione
CID 727382
(5E)-5-[(3,5-dibromo-4-hydroxyphenyl)methylidene]-3-methylimidazolidine-2,4-dione
CID 19374978
(5E)-5-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-2-sulfanylideneimidazolidin-4-one
CID 872597
5-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione
CID 5335495
(5E)-5-[(3,5-dibromo-4-hydroxyphenyl)methylidene]-3-ethylimidazolidine-2,4-dione
CID 126251195
5-[(3,5-dibromo-4-hydroxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
CID 4571049
ethyl 2-[2-bromo-4-[(E)-(2,5-dioxoimidazolidin-4-ylidene)methyl]-6-ethoxyphenoxy]acetate
CID 6163934
5-[(3-chloro-5-ethoxy-4-hydroxyphenyl)methylidene]imidazolidine-2,4-dione
CID 3264930

Frequently Asked Questions

What is the IUPAC name of 5-[(3,5-dibromo-4-hydroxyphenyl)methylidene]imidazolidine-2,4-dione?
The IUPAC name of 5-[(3,5-dibromo-4-hydroxyphenyl)methylidene]imidazolidine-2,4-dione (CID 78472496) is 5-[(3,5-dibromo-4-hydroxyphenyl)methylidene]imidazolidine-2,4-dione.
What is the SMILES notation for 5-[(3,5-dibromo-4-hydroxyphenyl)methylidene]imidazolidine-2,4-dione?
The canonical SMILES for 5-[(3,5-dibromo-4-hydroxyphenyl)methylidene]imidazolidine-2,4-dione is O=C1NC(=O)C(=Cc2cc(Br)c(O)c(Br)c2)N1.
What is the InChIKey of 5-[(3,5-dibromo-4-hydroxyphenyl)methylidene]imidazolidine-2,4-dione?
The InChIKey is YKWXNFDWIXFYKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6Br2N2O3/c11-5-1-4(2-6(12)8(5)15)3-7-9(16)14-10(17)13-7/h1-3,15H,(H2,13,14,16,17).
What are the key properties of 5-[(3,5-dibromo-4-hydroxyphenyl)methylidene]imidazolidine-2,4-dione?
5-[(3,5-dibromo-4-hydroxyphenyl)methylidene]imidazolidine-2,4-dione has a molecular weight of 361.98 g/mol, XLogP of 2.10, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(3,5-dibromo-4-hydroxyphenyl)methylidene]imidazolidine-2,4-dione is sourced from PubChem (CID 78472496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).