5-((4-Chlorophenyl)methylene)-3-methyl-2-selenoxo-4-imidazolidinone

C11H8ClN2OSe — CID 6435387

IUPAC—
SMILESCN1C(=O)/C(=C/c2ccc(Cl)cc2)N=C1[Se]
InChIInChI=1S/C11H8ClN2OSe/c1-14-10(15)9(13-11(14)16)6-7-2-4-8(12)5-3-7/h2-6H,1H3/b9-6-
InChIKeyZXPRGYFMTPGYFQ-TWGQIWQCSA-N
MW298.61 g/mol
LogP1.68
Rot. Bonds1

About 5-((4-Chlorophenyl)methylene)-3-methyl-2-selenoxo-4-imidazolidinone

5-((4-Chlorophenyl)methylene)-3-methyl-2-selenoxo-4-imidazolidinone (PubChem CID 6435387) has the molecular formula C11H8ClN2OSe and a molecular weight of 298.61 g/mol.

Molecular Properties

Compound Name5-((4-Chlorophenyl)methylene)-3-methyl-2-selenoxo-4-imidazolidinone
PubChem CID6435387
Molecular FormulaC11H8ClN2OSe
Molecular Weight298.61 g/mol
Exact Mass298.95
IUPAC Name—
SMILESCN1C(=O)/C(=C/c2ccc(Cl)cc2)N=C1[Se]
InChIInChI=1S/C11H8ClN2OSe/c1-14-10(15)9(13-11(14)16)6-7-2-4-8(12)5-3-7/h2-6H,1H3/b9-6-
InChIKeyZXPRGYFMTPGYFQ-TWGQIWQCSA-N
XLogP1.68
TPSA32.67 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.61
LogP ≤ 51.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-((4-Chlorophenyl)methylene)-3-methyl-2-selenoxo-4-imidazolidinone?
The IUPAC name of 5-((4-Chlorophenyl)methylene)-3-methyl-2-selenoxo-4-imidazolidinone (CID 6435387) is not available.
What is the SMILES notation for 5-((4-Chlorophenyl)methylene)-3-methyl-2-selenoxo-4-imidazolidinone?
The canonical SMILES for 5-((4-Chlorophenyl)methylene)-3-methyl-2-selenoxo-4-imidazolidinone is CN1C(=O)/C(=C/c2ccc(Cl)cc2)N=C1[Se].
What is the InChIKey of 5-((4-Chlorophenyl)methylene)-3-methyl-2-selenoxo-4-imidazolidinone?
The InChIKey is ZXPRGYFMTPGYFQ-TWGQIWQCSA-N. The full InChI is InChI=1S/C11H8ClN2OSe/c1-14-10(15)9(13-11(14)16)6-7-2-4-8(12)5-3-7/h2-6H,1H3/b9-6-.
What are the key properties of 5-((4-Chlorophenyl)methylene)-3-methyl-2-selenoxo-4-imidazolidinone?
5-((4-Chlorophenyl)methylene)-3-methyl-2-selenoxo-4-imidazolidinone has a molecular weight of 298.61 g/mol, XLogP of 1.68, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-((4-Chlorophenyl)methylene)-3-methyl-2-selenoxo-4-imidazolidinone is sourced from PubChem (CID 6435387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).