AC1LR0YF
2-[(3Z)-2-oxo-3-(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)indol-1-yl]acetic acid
Also Known As: oxoindole-thioxothiazolidinone, 30|BAS 00534170|BIM-0024247.P001|AF-399/36752038|[(3Z)-2-oxo-3-(4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)-2,3-dihydro-1H-indol-1-yl]acetic acid|2-{2-oxo-3-[(5Z)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-2,3-dihydro-1H-indol-1-yl}acetic acid|2-[(3Z)-2-oxo-3-(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)indol-1-yl]acetic acid|2-[2-oxo-3-(4-oxo-2-thioxo(1,3-thiazolidin-5-ylidene))benzo[d]azolinyl]acetic acid|[2-oxo-3-(4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)-2,3-dihydro-1H-indol-1-yl]acetic acid
| Molecular Formula | C13H8N2O4S2 |
|---|---|
| Molecular Weight | 319.99255 g/mol |
| LogP | 0.9768 |
| Topological Polar Surface Area | 86.71 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 319.99255 |
| Monoisotopic Mass | 319.99255 |
| Heavy Atoms | 21 |
| Complexity | 741.4417 |
Chemical Identifiers
| CAS Number | 5548-97-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)/C(=C/3\C(=O)NC(=S)S3)/C(=O)N2CC(=O)O |
Product Overview
AC1LR0YF (CAS 5548-97-0), with molecular formula C13H8N2O4S2 and molecular weight 319.99255 g/mol. IUPAC: 2-[(3Z)-2-oxo-3-(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)indol-1-yl]acetic acid.
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