3-phenylspiro[1,3-thiazolidine-2,3'-1H-indole]-2',4-dione

C16H12N2O2S — CID 2816054

IUPAC3-phenylspiro[1,3-thiazolidine-2,3'-1H-indole]-2',4-dione
SMILESO=C1CSC2(C(=O)Nc3ccccc32)N1c1ccccc1
InChIInChI=1S/C16H12N2O2S/c19-14-10-21-16(18(14)11-6-2-1-3-7-11)12-8-4-5-9-13(12)17-15(16)20/h1-9H,10H2,(H,17,20)
InChIKeyYOUZPGWSTPAIRL-UHFFFAOYSA-N
MW296.35 g/mol
LogP2.57
Rot. Bonds1

About 3-phenylspiro[1,3-thiazolidine-2,3'-1H-indole]-2',4-dione

3-phenylspiro[1,3-thiazolidine-2,3'-1H-indole]-2',4-dione (PubChem CID 2816054) has the molecular formula C16H12N2O2S and a molecular weight of 296.35 g/mol. Its IUPAC name is 3-phenylspiro[1,3-thiazolidine-2,3'-1H-indole]-2',4-dione.

Molecular Properties

Compound Name3-phenylspiro[1,3-thiazolidine-2,3'-1H-indole]-2',4-dione
PubChem CID2816054
Molecular FormulaC16H12N2O2S
Molecular Weight296.35 g/mol
Exact Mass296.06
IUPAC Name3-phenylspiro[1,3-thiazolidine-2,3'-1H-indole]-2',4-dione
SMILESO=C1CSC2(C(=O)Nc3ccccc32)N1c1ccccc1
InChIInChI=1S/C16H12N2O2S/c19-14-10-21-16(18(14)11-6-2-1-3-7-11)12-8-4-5-9-13(12)17-15(16)20/h1-9H,10H2,(H,17,20)
InChIKeyYOUZPGWSTPAIRL-UHFFFAOYSA-N
XLogP2.57
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.35
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-phenylspiro[1,3-thiazolidine-2,3'-1H-indole]-2',4-dione?
The IUPAC name of 3-phenylspiro[1,3-thiazolidine-2,3'-1H-indole]-2',4-dione (CID 2816054) is 3-phenylspiro[1,3-thiazolidine-2,3'-1H-indole]-2',4-dione.
What is the SMILES notation for 3-phenylspiro[1,3-thiazolidine-2,3'-1H-indole]-2',4-dione?
The canonical SMILES for 3-phenylspiro[1,3-thiazolidine-2,3'-1H-indole]-2',4-dione is O=C1CSC2(C(=O)Nc3ccccc32)N1c1ccccc1.
What is the InChIKey of 3-phenylspiro[1,3-thiazolidine-2,3'-1H-indole]-2',4-dione?
The InChIKey is YOUZPGWSTPAIRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N2O2S/c19-14-10-21-16(18(14)11-6-2-1-3-7-11)12-8-4-5-9-13(12)17-15(16)20/h1-9H,10H2,(H,17,20).
What are the key properties of 3-phenylspiro[1,3-thiazolidine-2,3'-1H-indole]-2',4-dione?
3-phenylspiro[1,3-thiazolidine-2,3'-1H-indole]-2',4-dione has a molecular weight of 296.35 g/mol, XLogP of 2.57, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenylspiro[1,3-thiazolidine-2,3'-1H-indole]-2',4-dione is sourced from PubChem (CID 2816054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).