(2S)-1'-methyl-3-phenylspiro[1,3-thiazolidine-2,3'-indole]-2',4-dione

C17H14N2O2S — CID 40660267

IUPAC(2S)-1'-methyl-3-phenylspiro[1,3-thiazolidine-2,3'-indole]-2',4-dione
SMILESCN1C(=O)[C@@]2(SCC(=O)N2c2ccccc2)c2ccccc21
InChIInChI=1S/C17H14N2O2S/c1-18-14-10-6-5-9-13(14)17(16(18)21)19(15(20)11-22-17)12-7-3-2-4-8-12/h2-10H,11H2,1H3/t17-/m0/s1
InChIKeyPDQHJJMVPACXLF-KRWDZBQOSA-N
MW310.38 g/mol
LogP2.60
Rot. Bonds1

About (2S)-1'-methyl-3-phenylspiro[1,3-thiazolidine-2,3'-indole]-2',4-dione

(2S)-1'-methyl-3-phenylspiro[1,3-thiazolidine-2,3'-indole]-2',4-dione (PubChem CID 40660267) has the molecular formula C17H14N2O2S and a molecular weight of 310.38 g/mol. Its IUPAC name is (2S)-1'-methyl-3-phenylspiro[1,3-thiazolidine-2,3'-indole]-2',4-dione.

Molecular Properties

Compound Name(2S)-1'-methyl-3-phenylspiro[1,3-thiazolidine-2,3'-indole]-2',4-dione
PubChem CID40660267
Molecular FormulaC17H14N2O2S
Molecular Weight310.38 g/mol
Exact Mass310.08
IUPAC Name(2S)-1'-methyl-3-phenylspiro[1,3-thiazolidine-2,3'-indole]-2',4-dione
SMILESCN1C(=O)[C@@]2(SCC(=O)N2c2ccccc2)c2ccccc21
InChIInChI=1S/C17H14N2O2S/c1-18-14-10-6-5-9-13(14)17(16(18)21)19(15(20)11-22-17)12-7-3-2-4-8-12/h2-10H,11H2,1H3/t17-/m0/s1
InChIKeyPDQHJJMVPACXLF-KRWDZBQOSA-N
XLogP2.60
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.38
LogP ≤ 52.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-3-(3,4-dimethylphenyl)-1'-methylspiro[1,3-thiazolidine-2,3'-indole]-2',4-dione
CID 7245471
3-(3,4-difluorophenyl)-1'-methylspiro[1,3-thiazolidine-2,3'-indole]-2',4-dione
CID 20922099
1'-acetyl-3-phenylspiro[1,3-thiazolidine-2,3'-indole]-2',4-dione
CID 12750665
1'-[(4-chlorophenyl)methyl]-3-phenylspiro[1,3-thiazolidine-2,3'-indole]-2',4-dione
CID 3263594
1'-(morpholin-4-ylmethyl)-3-phenylspiro[1,3-thiazolidine-2,3'-indole]-2',4-dione
CID 12750664
(2S)-1'-acetyl-3-(4-fluorophenyl)spiro[1,3-thiazolidine-2,3'-indole]-2',4-dione
CID 42554574
2-[(2S)-2',4-dioxo-3-phenylspiro[1,3-thiazolidine-2,3'-indole]-1'-yl]-N-(4-methylphenyl)acetamide
CID 92691950
(2S)-1'-[(4-benzylpiperidin-1-yl)methyl]-3-phenylspiro[1,3-thiazolidine-2,3'-indole]-2',4-dione
CID 100816729
3-phenyl-1'-[[3-(trifluoromethyl)phenyl]methyl]spiro[1,3-thiazolidine-2,3'-indole]-2',4-dione
CID 3733061
N-(3,4-dimethylphenyl)-2-[(2S)-2',4-dioxo-3-phenylspiro[1,3-thiazolidine-2,3'-indole]-1'-yl]acetamide
CID 92691956
2-[(2S)-2',4-dioxo-3-phenylspiro[1,3-thiazolidine-2,3'-indole]-1'-yl]-N-(2-methoxyphenyl)acetamide
CID 92691954
1'-[(2-chlorophenyl)methyl]-3-(4-methylphenyl)spiro[1,3-thiazolidine-2,3'-indole]-2',4-dione
CID 17138852

Frequently Asked Questions

What is the IUPAC name of (2S)-1'-methyl-3-phenylspiro[1,3-thiazolidine-2,3'-indole]-2',4-dione?
The IUPAC name of (2S)-1'-methyl-3-phenylspiro[1,3-thiazolidine-2,3'-indole]-2',4-dione (CID 40660267) is (2S)-1'-methyl-3-phenylspiro[1,3-thiazolidine-2,3'-indole]-2',4-dione.
What is the SMILES notation for (2S)-1'-methyl-3-phenylspiro[1,3-thiazolidine-2,3'-indole]-2',4-dione?
The canonical SMILES for (2S)-1'-methyl-3-phenylspiro[1,3-thiazolidine-2,3'-indole]-2',4-dione is CN1C(=O)[C@@]2(SCC(=O)N2c2ccccc2)c2ccccc21.
What is the InChIKey of (2S)-1'-methyl-3-phenylspiro[1,3-thiazolidine-2,3'-indole]-2',4-dione?
The InChIKey is PDQHJJMVPACXLF-KRWDZBQOSA-N. The full InChI is InChI=1S/C17H14N2O2S/c1-18-14-10-6-5-9-13(14)17(16(18)21)19(15(20)11-22-17)12-7-3-2-4-8-12/h2-10H,11H2,1H3/t17-/m0/s1.
What are the key properties of (2S)-1'-methyl-3-phenylspiro[1,3-thiazolidine-2,3'-indole]-2',4-dione?
(2S)-1'-methyl-3-phenylspiro[1,3-thiazolidine-2,3'-indole]-2',4-dione has a molecular weight of 310.38 g/mol, XLogP of 2.60, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-1'-methyl-3-phenylspiro[1,3-thiazolidine-2,3'-indole]-2',4-dione is sourced from PubChem (CID 40660267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).