(5Z)-5-[(3-chlorophenyl)methylidene]-3-phenylimidazolidine-2,4-dione

C16H11ClN2O2 — CID 6158471

IUPAC(5Z)-5-[(3-chlorophenyl)methylidene]-3-phenylimidazolidine-2,4-dione
SMILESO=C1N/C(=C\c2cccc(Cl)c2)C(=O)N1c1ccccc1
InChIInChI=1S/C16H11ClN2O2/c17-12-6-4-5-11(9-12)10-14-15(20)19(16(21)18-14)13-7-2-1-3-8-13/h1-10H,(H,18,21)/b14-10-
InChIKeyAWJXHOSDBIIRKH-UVTDQMKNSA-N
MW298.73 g/mol
LogP3.44
Rot. Bonds2

About (5Z)-5-[(3-chlorophenyl)methylidene]-3-phenylimidazolidine-2,4-dione

(5Z)-5-[(3-chlorophenyl)methylidene]-3-phenylimidazolidine-2,4-dione (PubChem CID 6158471) has the molecular formula C16H11ClN2O2 and a molecular weight of 298.73 g/mol. Its IUPAC name is (5Z)-5-[(3-chlorophenyl)methylidene]-3-phenylimidazolidine-2,4-dione.

Molecular Properties

Compound Name(5Z)-5-[(3-chlorophenyl)methylidene]-3-phenylimidazolidine-2,4-dione
PubChem CID6158471
Molecular FormulaC16H11ClN2O2
Molecular Weight298.73 g/mol
Exact Mass298.05
IUPAC Name(5Z)-5-[(3-chlorophenyl)methylidene]-3-phenylimidazolidine-2,4-dione
SMILESO=C1N/C(=C\c2cccc(Cl)c2)C(=O)N1c1ccccc1
InChIInChI=1S/C16H11ClN2O2/c17-12-6-4-5-11(9-12)10-14-15(20)19(16(21)18-14)13-7-2-1-3-8-13/h1-10H,(H,18,21)/b14-10-
InChIKeyAWJXHOSDBIIRKH-UVTDQMKNSA-N
XLogP3.44
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.73
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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-[(3-chlorophenyl)methylidene]-3-phenylimidazolidine-2,4-dione?
The IUPAC name of (5Z)-5-[(3-chlorophenyl)methylidene]-3-phenylimidazolidine-2,4-dione (CID 6158471) is (5Z)-5-[(3-chlorophenyl)methylidene]-3-phenylimidazolidine-2,4-dione.
What is the SMILES notation for (5Z)-5-[(3-chlorophenyl)methylidene]-3-phenylimidazolidine-2,4-dione?
The canonical SMILES for (5Z)-5-[(3-chlorophenyl)methylidene]-3-phenylimidazolidine-2,4-dione is O=C1N/C(=C\c2cccc(Cl)c2)C(=O)N1c1ccccc1.
What is the InChIKey of (5Z)-5-[(3-chlorophenyl)methylidene]-3-phenylimidazolidine-2,4-dione?
The InChIKey is AWJXHOSDBIIRKH-UVTDQMKNSA-N. The full InChI is InChI=1S/C16H11ClN2O2/c17-12-6-4-5-11(9-12)10-14-15(20)19(16(21)18-14)13-7-2-1-3-8-13/h1-10H,(H,18,21)/b14-10-.
What are the key properties of (5Z)-5-[(3-chlorophenyl)methylidene]-3-phenylimidazolidine-2,4-dione?
(5Z)-5-[(3-chlorophenyl)methylidene]-3-phenylimidazolidine-2,4-dione has a molecular weight of 298.73 g/mol, XLogP of 3.44, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z)-5-[(3-chlorophenyl)methylidene]-3-phenylimidazolidine-2,4-dione is sourced from PubChem (CID 6158471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).