3-(4-methoxyphenyl)spiro[1,3-thiazolidine-2,3'-1H-indole]-2',4-dione

C17H14N2O3S — CID 2732518

IUPAC3-(4-methoxyphenyl)spiro[1,3-thiazolidine-2,3'-1H-indole]-2',4-dione
SMILESCOc1ccc(N2C(=O)CSC23C(=O)Nc2ccccc23)cc1
InChIInChI=1S/C17H14N2O3S/c1-22-12-8-6-11(7-9-12)19-15(20)10-23-17(19)13-4-2-3-5-14(13)18-16(17)21/h2-9H,10H2,1H3,(H,18,21)
InChIKeyRLJZCFZGIVVNEA-UHFFFAOYSA-N
MW326.38 g/mol
LogP2.58
Rot. Bonds2

About 3-(4-methoxyphenyl)spiro[1,3-thiazolidine-2,3'-1H-indole]-2',4-dione

3-(4-methoxyphenyl)spiro[1,3-thiazolidine-2,3'-1H-indole]-2',4-dione (PubChem CID 2732518) has the molecular formula C17H14N2O3S and a molecular weight of 326.38 g/mol. Its IUPAC name is 3-(4-methoxyphenyl)spiro[1,3-thiazolidine-2,3'-1H-indole]-2',4-dione.

Molecular Properties

Compound Name3-(4-methoxyphenyl)spiro[1,3-thiazolidine-2,3'-1H-indole]-2',4-dione
PubChem CID2732518
Molecular FormulaC17H14N2O3S
Molecular Weight326.38 g/mol
Exact Mass326.07
IUPAC Name3-(4-methoxyphenyl)spiro[1,3-thiazolidine-2,3'-1H-indole]-2',4-dione
SMILESCOc1ccc(N2C(=O)CSC23C(=O)Nc2ccccc23)cc1
InChIInChI=1S/C17H14N2O3S/c1-22-12-8-6-11(7-9-12)19-15(20)10-23-17(19)13-4-2-3-5-14(13)18-16(17)21/h2-9H,10H2,1H3,(H,18,21)
InChIKeyRLJZCFZGIVVNEA-UHFFFAOYSA-N
XLogP2.58
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.38
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(4-methoxyphenyl)spiro[1,3-thiazolidine-2,3'-1H-indole]-2',4-dione?
The IUPAC name of 3-(4-methoxyphenyl)spiro[1,3-thiazolidine-2,3'-1H-indole]-2',4-dione (CID 2732518) is 3-(4-methoxyphenyl)spiro[1,3-thiazolidine-2,3'-1H-indole]-2',4-dione.
What is the SMILES notation for 3-(4-methoxyphenyl)spiro[1,3-thiazolidine-2,3'-1H-indole]-2',4-dione?
The canonical SMILES for 3-(4-methoxyphenyl)spiro[1,3-thiazolidine-2,3'-1H-indole]-2',4-dione is COc1ccc(N2C(=O)CSC23C(=O)Nc2ccccc23)cc1.
What is the InChIKey of 3-(4-methoxyphenyl)spiro[1,3-thiazolidine-2,3'-1H-indole]-2',4-dione?
The InChIKey is RLJZCFZGIVVNEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2O3S/c1-22-12-8-6-11(7-9-12)19-15(20)10-23-17(19)13-4-2-3-5-14(13)18-16(17)21/h2-9H,10H2,1H3,(H,18,21).
What are the key properties of 3-(4-methoxyphenyl)spiro[1,3-thiazolidine-2,3'-1H-indole]-2',4-dione?
3-(4-methoxyphenyl)spiro[1,3-thiazolidine-2,3'-1H-indole]-2',4-dione has a molecular weight of 326.38 g/mol, XLogP of 2.58, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methoxyphenyl)spiro[1,3-thiazolidine-2,3'-1H-indole]-2',4-dione is sourced from PubChem (CID 2732518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).