[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-benzo[e][1]benzofuran-1-ylacetate

C19H16N2O5 — CID 8525583

IUPAC[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-benzo[e][1]benzofuran-1-ylacetate
SMILESO=C(Cc1coc2ccc3ccccc3c12)OCC(=O)N1CCNC1=O
InChIInChI=1S/C19H16N2O5/c22-16(21-8-7-20-19(21)24)11-26-17(23)9-13-10-25-15-6-5-12-3-1-2-4-14(12)18(13)15/h1-6,10H,7-9,11H2,(H,20,24)
InChIKeyLRALJLMJRCGAEB-UHFFFAOYSA-N
MW352.35 g/mol
LogP2.22
Rot. Bonds4

About [2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-benzo[e][1]benzofuran-1-ylacetate

[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-benzo[e][1]benzofuran-1-ylacetate (PubChem CID 8525583) has the molecular formula C19H16N2O5 and a molecular weight of 352.35 g/mol. Its IUPAC name is [2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-benzo[e][1]benzofuran-1-ylacetate.

Molecular Properties

Compound Name[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-benzo[e][1]benzofuran-1-ylacetate
PubChem CID8525583
Molecular FormulaC19H16N2O5
Molecular Weight352.35 g/mol
Exact Mass352.11
IUPAC Name[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-benzo[e][1]benzofuran-1-ylacetate
SMILESO=C(Cc1coc2ccc3ccccc3c12)OCC(=O)N1CCNC1=O
InChIInChI=1S/C19H16N2O5/c22-16(21-8-7-20-19(21)24)11-26-17(23)9-13-10-25-15-6-5-12-3-1-2-4-14(12)18(13)15/h1-6,10H,7-9,11H2,(H,20,24)
InChIKeyLRALJLMJRCGAEB-UHFFFAOYSA-N
XLogP2.22
TPSA88.85 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.35
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-benzo[e][1]benzofuran-1-ylacetate?
The IUPAC name of [2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-benzo[e][1]benzofuran-1-ylacetate (CID 8525583) is [2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-benzo[e][1]benzofuran-1-ylacetate.
What is the SMILES notation for [2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-benzo[e][1]benzofuran-1-ylacetate?
The canonical SMILES for [2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-benzo[e][1]benzofuran-1-ylacetate is O=C(Cc1coc2ccc3ccccc3c12)OCC(=O)N1CCNC1=O.
What is the InChIKey of [2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-benzo[e][1]benzofuran-1-ylacetate?
The InChIKey is LRALJLMJRCGAEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O5/c22-16(21-8-7-20-19(21)24)11-26-17(23)9-13-10-25-15-6-5-12-3-1-2-4-14(12)18(13)15/h1-6,10H,7-9,11H2,(H,20,24).
What are the key properties of [2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-benzo[e][1]benzofuran-1-ylacetate?
[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-benzo[e][1]benzofuran-1-ylacetate has a molecular weight of 352.35 g/mol, XLogP of 2.22, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-benzo[e][1]benzofuran-1-ylacetate is sourced from PubChem (CID 8525583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).