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

C17H14N2O3 — CID 127041661

IUPAC(5Z)-5-[(4-hydroxyphenyl)methylidene]-3-(4-methylphenyl)imidazolidine-2,4-dione
SMILESCc1ccc(N2C(=O)N/C(=C\c3ccc(O)cc3)C2=O)cc1
InChIInChI=1S/C17H14N2O3/c1-11-2-6-13(7-3-11)19-16(21)15(18-17(19)22)10-12-4-8-14(20)9-5-12/h2-10,20H,1H3,(H,18,22)/b15-10-
InChIKeyKGYMUDGRWJOVCO-GDNBJRDFSA-N
MW294.31 g/mol
LogP2.80
Rot. Bonds2

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

(5Z)-5-[(4-hydroxyphenyl)methylidene]-3-(4-methylphenyl)imidazolidine-2,4-dione (PubChem CID 127041661) has the molecular formula C17H14N2O3 and a molecular weight of 294.31 g/mol. Its IUPAC name is (5Z)-5-[(4-hydroxyphenyl)methylidene]-3-(4-methylphenyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name(5Z)-5-[(4-hydroxyphenyl)methylidene]-3-(4-methylphenyl)imidazolidine-2,4-dione
PubChem CID127041661
Molecular FormulaC17H14N2O3
Molecular Weight294.31 g/mol
Exact Mass294.10
IUPAC Name(5Z)-5-[(4-hydroxyphenyl)methylidene]-3-(4-methylphenyl)imidazolidine-2,4-dione
SMILESCc1ccc(N2C(=O)N/C(=C\c3ccc(O)cc3)C2=O)cc1
InChIInChI=1S/C17H14N2O3/c1-11-2-6-13(7-3-11)19-16(21)15(18-17(19)22)10-12-4-8-14(20)9-5-12/h2-10,20H,1H3,(H,18,22)/b15-10-
InChIKeyKGYMUDGRWJOVCO-GDNBJRDFSA-N
XLogP2.80
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.31
LogP ≤ 52.80
H-Bond Donors ≤ 52
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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Frequently Asked Questions

What is the IUPAC name of (5Z)-5-[(4-hydroxyphenyl)methylidene]-3-(4-methylphenyl)imidazolidine-2,4-dione?
The IUPAC name of (5Z)-5-[(4-hydroxyphenyl)methylidene]-3-(4-methylphenyl)imidazolidine-2,4-dione (CID 127041661) is (5Z)-5-[(4-hydroxyphenyl)methylidene]-3-(4-methylphenyl)imidazolidine-2,4-dione.
What is the SMILES notation for (5Z)-5-[(4-hydroxyphenyl)methylidene]-3-(4-methylphenyl)imidazolidine-2,4-dione?
The canonical SMILES for (5Z)-5-[(4-hydroxyphenyl)methylidene]-3-(4-methylphenyl)imidazolidine-2,4-dione is Cc1ccc(N2C(=O)N/C(=C\c3ccc(O)cc3)C2=O)cc1.
What is the InChIKey of (5Z)-5-[(4-hydroxyphenyl)methylidene]-3-(4-methylphenyl)imidazolidine-2,4-dione?
The InChIKey is KGYMUDGRWJOVCO-GDNBJRDFSA-N. The full InChI is InChI=1S/C17H14N2O3/c1-11-2-6-13(7-3-11)19-16(21)15(18-17(19)22)10-12-4-8-14(20)9-5-12/h2-10,20H,1H3,(H,18,22)/b15-10-.
What are the key properties of (5Z)-5-[(4-hydroxyphenyl)methylidene]-3-(4-methylphenyl)imidazolidine-2,4-dione?
(5Z)-5-[(4-hydroxyphenyl)methylidene]-3-(4-methylphenyl)imidazolidine-2,4-dione has a molecular weight of 294.31 g/mol, XLogP of 2.80, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z)-5-[(4-hydroxyphenyl)methylidene]-3-(4-methylphenyl)imidazolidine-2,4-dione is sourced from PubChem (CID 127041661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).