(5Z)-5-(imidazo[1,2-a]pyridin-6-ylmethylidene)-1,3-thiazolidine-2,4-dione

C11H7N3O2S — CID 24802861

IUPAC(5Z)-5-(imidazo[1,2-a]pyridin-6-ylmethylidene)-1,3-thiazolidine-2,4-dione
SMILESO=C1NC(=O)/C(=C/c2ccc3nccn3c2)S1
InChIInChI=1S/C11H7N3O2S/c15-10-8(17-11(16)13-10)5-7-1-2-9-12-3-4-14(9)6-7/h1-6H,(H,13,15,16)/b8-5-
InChIKeyDFTCAYSTZWPWLU-YVMONPNESA-N
MW245.26 g/mol
LogP1.66
Rot. Bonds1

About (5Z)-5-(imidazo[1,2-a]pyridin-6-ylmethylidene)-1,3-thiazolidine-2,4-dione

(5Z)-5-(imidazo[1,2-a]pyridin-6-ylmethylidene)-1,3-thiazolidine-2,4-dione (PubChem CID 24802861) has the molecular formula C11H7N3O2S and a molecular weight of 245.26 g/mol. Its IUPAC name is (5Z)-5-(imidazo[1,2-a]pyridin-6-ylmethylidene)-1,3-thiazolidine-2,4-dione.

Molecular Properties

Compound Name(5Z)-5-(imidazo[1,2-a]pyridin-6-ylmethylidene)-1,3-thiazolidine-2,4-dione
PubChem CID24802861
Molecular FormulaC11H7N3O2S
Molecular Weight245.26 g/mol
Exact Mass245.03
IUPAC Name(5Z)-5-(imidazo[1,2-a]pyridin-6-ylmethylidene)-1,3-thiazolidine-2,4-dione
SMILESO=C1NC(=O)/C(=C/c2ccc3nccn3c2)S1
InChIInChI=1S/C11H7N3O2S/c15-10-8(17-11(16)13-10)5-7-1-2-9-12-3-4-14(9)6-7/h1-6H,(H,13,15,16)/b8-5-
InChIKeyDFTCAYSTZWPWLU-YVMONPNESA-N
XLogP1.66
TPSA63.47 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.26
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (5Z)-5-(imidazo[1,2-a]pyridin-6-ylmethylidene)-1,3-thiazolidine-2,4-dione?
The IUPAC name of (5Z)-5-(imidazo[1,2-a]pyridin-6-ylmethylidene)-1,3-thiazolidine-2,4-dione (CID 24802861) is (5Z)-5-(imidazo[1,2-a]pyridin-6-ylmethylidene)-1,3-thiazolidine-2,4-dione.
What is the SMILES notation for (5Z)-5-(imidazo[1,2-a]pyridin-6-ylmethylidene)-1,3-thiazolidine-2,4-dione?
The canonical SMILES for (5Z)-5-(imidazo[1,2-a]pyridin-6-ylmethylidene)-1,3-thiazolidine-2,4-dione is O=C1NC(=O)/C(=C/c2ccc3nccn3c2)S1.
What is the InChIKey of (5Z)-5-(imidazo[1,2-a]pyridin-6-ylmethylidene)-1,3-thiazolidine-2,4-dione?
The InChIKey is DFTCAYSTZWPWLU-YVMONPNESA-N. The full InChI is InChI=1S/C11H7N3O2S/c15-10-8(17-11(16)13-10)5-7-1-2-9-12-3-4-14(9)6-7/h1-6H,(H,13,15,16)/b8-5-.
What are the key properties of (5Z)-5-(imidazo[1,2-a]pyridin-6-ylmethylidene)-1,3-thiazolidine-2,4-dione?
(5Z)-5-(imidazo[1,2-a]pyridin-6-ylmethylidene)-1,3-thiazolidine-2,4-dione has a molecular weight of 245.26 g/mol, XLogP of 1.66, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z)-5-(imidazo[1,2-a]pyridin-6-ylmethylidene)-1,3-thiazolidine-2,4-dione is sourced from PubChem (CID 24802861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).