(2E)-2-[(Z)-1-(furan-2-yl)ethylidenehydrazinylidene]-1,3-thiazolidin-4-one

C9H9N3O2S — CID 137100917

IUPAC(2E)-2-[(Z)-1-(furan-2-yl)ethylidenehydrazinylidene]-1,3-thiazolidin-4-one
SMILESC/C(=N/N=C1\NC(=O)CS1)c1ccco1
InChIInChI=1S/C9H9N3O2S/c1-6(7-3-2-4-14-7)11-12-9-10-8(13)5-15-9/h2-4H,5H2,1H3,(H,10,12,13)/b11-6-
InChIKeyDBXVSDKEZUTRHJ-WDZFZDKYSA-N
MW223.26 g/mol
LogP1.22
Rot. Bonds2

About (2E)-2-[(Z)-1-(furan-2-yl)ethylidenehydrazinylidene]-1,3-thiazolidin-4-one

(2E)-2-[(Z)-1-(furan-2-yl)ethylidenehydrazinylidene]-1,3-thiazolidin-4-one (PubChem CID 137100917) has the molecular formula C9H9N3O2S and a molecular weight of 223.26 g/mol. Its IUPAC name is (2E)-2-[(Z)-1-(furan-2-yl)ethylidenehydrazinylidene]-1,3-thiazolidin-4-one.

Molecular Properties

Compound Name(2E)-2-[(Z)-1-(furan-2-yl)ethylidenehydrazinylidene]-1,3-thiazolidin-4-one
PubChem CID137100917
Molecular FormulaC9H9N3O2S
Molecular Weight223.26 g/mol
Exact Mass223.04
IUPAC Name(2E)-2-[(Z)-1-(furan-2-yl)ethylidenehydrazinylidene]-1,3-thiazolidin-4-one
SMILESC/C(=N/N=C1\NC(=O)CS1)c1ccco1
InChIInChI=1S/C9H9N3O2S/c1-6(7-3-2-4-14-7)11-12-9-10-8(13)5-15-9/h2-4H,5H2,1H3,(H,10,12,13)/b11-6-
InChIKeyDBXVSDKEZUTRHJ-WDZFZDKYSA-N
XLogP1.22
TPSA66.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.26
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2E)-2-[(Z)-1-(furan-2-yl)ethylidenehydrazinylidene]-1,3-thiazolidin-4-one?
The IUPAC name of (2E)-2-[(Z)-1-(furan-2-yl)ethylidenehydrazinylidene]-1,3-thiazolidin-4-one (CID 137100917) is (2E)-2-[(Z)-1-(furan-2-yl)ethylidenehydrazinylidene]-1,3-thiazolidin-4-one.
What is the SMILES notation for (2E)-2-[(Z)-1-(furan-2-yl)ethylidenehydrazinylidene]-1,3-thiazolidin-4-one?
The canonical SMILES for (2E)-2-[(Z)-1-(furan-2-yl)ethylidenehydrazinylidene]-1,3-thiazolidin-4-one is C/C(=N/N=C1\NC(=O)CS1)c1ccco1.
What is the InChIKey of (2E)-2-[(Z)-1-(furan-2-yl)ethylidenehydrazinylidene]-1,3-thiazolidin-4-one?
The InChIKey is DBXVSDKEZUTRHJ-WDZFZDKYSA-N. The full InChI is InChI=1S/C9H9N3O2S/c1-6(7-3-2-4-14-7)11-12-9-10-8(13)5-15-9/h2-4H,5H2,1H3,(H,10,12,13)/b11-6-.
What are the key properties of (2E)-2-[(Z)-1-(furan-2-yl)ethylidenehydrazinylidene]-1,3-thiazolidin-4-one?
(2E)-2-[(Z)-1-(furan-2-yl)ethylidenehydrazinylidene]-1,3-thiazolidin-4-one has a molecular weight of 223.26 g/mol, XLogP of 1.22, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2E)-2-[(Z)-1-(furan-2-yl)ethylidenehydrazinylidene]-1,3-thiazolidin-4-one is sourced from PubChem (CID 137100917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).