5-(6-hydroxy-2,3-dihydro-1H-indol-3-yl)-1,3-thiazolidine-2,4-dione

C11H10N2O3S — CID 89046657

IUPAC5-(6-hydroxy-2,3-dihydro-1H-indol-3-yl)-1,3-thiazolidine-2,4-dione
SMILESO=C1NC(=O)C(C2CNc3cc(O)ccc32)S1
InChIInChI=1S/C11H10N2O3S/c14-5-1-2-6-7(4-12-8(6)3-5)9-10(15)13-11(16)17-9/h1-3,7,9,12,14H,4H2,(H,13,15,16)
InChIKeyLRFXIDPMQZTCLT-UHFFFAOYSA-N
MW250.28 g/mol
LogP1.25
Rot. Bonds1

About 5-(6-hydroxy-2,3-dihydro-1H-indol-3-yl)-1,3-thiazolidine-2,4-dione

5-(6-hydroxy-2,3-dihydro-1H-indol-3-yl)-1,3-thiazolidine-2,4-dione (PubChem CID 89046657) has the molecular formula C11H10N2O3S and a molecular weight of 250.28 g/mol. Its IUPAC name is 5-(6-hydroxy-2,3-dihydro-1H-indol-3-yl)-1,3-thiazolidine-2,4-dione.

Molecular Properties

Compound Name5-(6-hydroxy-2,3-dihydro-1H-indol-3-yl)-1,3-thiazolidine-2,4-dione
PubChem CID89046657
Molecular FormulaC11H10N2O3S
Molecular Weight250.28 g/mol
Exact Mass250.04
IUPAC Name5-(6-hydroxy-2,3-dihydro-1H-indol-3-yl)-1,3-thiazolidine-2,4-dione
SMILESO=C1NC(=O)C(C2CNc3cc(O)ccc32)S1
InChIInChI=1S/C11H10N2O3S/c14-5-1-2-6-7(4-12-8(6)3-5)9-10(15)13-11(16)17-9/h1-3,7,9,12,14H,4H2,(H,13,15,16)
InChIKeyLRFXIDPMQZTCLT-UHFFFAOYSA-N
XLogP1.25
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.28
LogP ≤ 51.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 5-(6-hydroxy-2,3-dihydro-1H-indol-3-yl)-1,3-thiazolidine-2,4-dione with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-(6-hydroxy-2,3-dihydro-1H-indol-3-yl)-1,3-thiazolidine-2,4-dione?
The IUPAC name of 5-(6-hydroxy-2,3-dihydro-1H-indol-3-yl)-1,3-thiazolidine-2,4-dione (CID 89046657) is 5-(6-hydroxy-2,3-dihydro-1H-indol-3-yl)-1,3-thiazolidine-2,4-dione.
What is the SMILES notation for 5-(6-hydroxy-2,3-dihydro-1H-indol-3-yl)-1,3-thiazolidine-2,4-dione?
The canonical SMILES for 5-(6-hydroxy-2,3-dihydro-1H-indol-3-yl)-1,3-thiazolidine-2,4-dione is O=C1NC(=O)C(C2CNc3cc(O)ccc32)S1.
What is the InChIKey of 5-(6-hydroxy-2,3-dihydro-1H-indol-3-yl)-1,3-thiazolidine-2,4-dione?
The InChIKey is LRFXIDPMQZTCLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O3S/c14-5-1-2-6-7(4-12-8(6)3-5)9-10(15)13-11(16)17-9/h1-3,7,9,12,14H,4H2,(H,13,15,16).
What are the key properties of 5-(6-hydroxy-2,3-dihydro-1H-indol-3-yl)-1,3-thiazolidine-2,4-dione?
5-(6-hydroxy-2,3-dihydro-1H-indol-3-yl)-1,3-thiazolidine-2,4-dione has a molecular weight of 250.28 g/mol, XLogP of 1.25, 1 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(6-hydroxy-2,3-dihydro-1H-indol-3-yl)-1,3-thiazolidine-2,4-dione is sourced from PubChem (CID 89046657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).