(5Z)-5-[(4-thiophen-2-ylphenyl)methylidene]imidazolidine-2,4-dione

C14H10N2O2S — CID 44590760

IUPAC(5Z)-5-[(4-thiophen-2-ylphenyl)methylidene]imidazolidine-2,4-dione
SMILESO=C1NC(=O)/C(=C/c2ccc(-c3cccs3)cc2)N1
InChIInChI=1S/C14H10N2O2S/c17-13-11(15-14(18)16-13)8-9-3-5-10(6-4-9)12-2-1-7-19-12/h1-8H,(H2,15,16,17,18)/b11-8-
InChIKeyFFMNALVOYZWDTH-FLIBITNWSA-N
MW270.31 g/mol
LogP2.60
Rot. Bonds2

About (5Z)-5-[(4-thiophen-2-ylphenyl)methylidene]imidazolidine-2,4-dione

(5Z)-5-[(4-thiophen-2-ylphenyl)methylidene]imidazolidine-2,4-dione (PubChem CID 44590760) has the molecular formula C14H10N2O2S and a molecular weight of 270.31 g/mol. Its IUPAC name is (5Z)-5-[(4-thiophen-2-ylphenyl)methylidene]imidazolidine-2,4-dione.

Molecular Properties

Compound Name(5Z)-5-[(4-thiophen-2-ylphenyl)methylidene]imidazolidine-2,4-dione
PubChem CID44590760
Molecular FormulaC14H10N2O2S
Molecular Weight270.31 g/mol
Exact Mass270.05
IUPAC Name(5Z)-5-[(4-thiophen-2-ylphenyl)methylidene]imidazolidine-2,4-dione
SMILESO=C1NC(=O)/C(=C/c2ccc(-c3cccs3)cc2)N1
InChIInChI=1S/C14H10N2O2S/c17-13-11(15-14(18)16-13)8-9-3-5-10(6-4-9)12-2-1-7-19-12/h1-8H,(H2,15,16,17,18)/b11-8-
InChIKeyFFMNALVOYZWDTH-FLIBITNWSA-N
XLogP2.60
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.31
LogP ≤ 52.60
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-thiophen-2-ylphenyl)methylidene]imidazolidine-2,4-dione?
The IUPAC name of (5Z)-5-[(4-thiophen-2-ylphenyl)methylidene]imidazolidine-2,4-dione (CID 44590760) is (5Z)-5-[(4-thiophen-2-ylphenyl)methylidene]imidazolidine-2,4-dione.
What is the SMILES notation for (5Z)-5-[(4-thiophen-2-ylphenyl)methylidene]imidazolidine-2,4-dione?
The canonical SMILES for (5Z)-5-[(4-thiophen-2-ylphenyl)methylidene]imidazolidine-2,4-dione is O=C1NC(=O)/C(=C/c2ccc(-c3cccs3)cc2)N1.
What is the InChIKey of (5Z)-5-[(4-thiophen-2-ylphenyl)methylidene]imidazolidine-2,4-dione?
The InChIKey is FFMNALVOYZWDTH-FLIBITNWSA-N. The full InChI is InChI=1S/C14H10N2O2S/c17-13-11(15-14(18)16-13)8-9-3-5-10(6-4-9)12-2-1-7-19-12/h1-8H,(H2,15,16,17,18)/b11-8-.
What are the key properties of (5Z)-5-[(4-thiophen-2-ylphenyl)methylidene]imidazolidine-2,4-dione?
(5Z)-5-[(4-thiophen-2-ylphenyl)methylidene]imidazolidine-2,4-dione has a molecular weight of 270.31 g/mol, XLogP of 2.60, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z)-5-[(4-thiophen-2-ylphenyl)methylidene]imidazolidine-2,4-dione is sourced from PubChem (CID 44590760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).