AC1MBBCX
6-[(5E)-5-(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid
Also Known As: F3215-0241|(E)-6-(5-((2,3-dihydrobenzo[b][1,4]dioxin-6-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)hexanoic acid|6-[(5E)-5-(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid|6-[(5E)-5-[(2,3-dihydro-1,4-benzodioxin-6-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid|6-[(5E)-5-(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]hexanoic acid|6-[(E)-5-[(2,3-dihydro-1,4-benzodioxin-6-yl)methylene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]hexanoic acid|6-[5-(2H,3H-benzo[3,4-e]1,4-dioxan-6-ylmethylene)-4-oxo-2-thioxo-1,3-thiazolid in-3-yl]hexanoic acid
| Molecular Formula | C18H19NO5S2 |
|---|---|
| Molecular Weight | 393.07047 g/mol |
| LogP | 3.304 |
| Topological Polar Surface Area | 76.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 393.07047 |
| Monoisotopic Mass | 393.07047 |
| Heavy Atoms | 26 |
| Complexity | 761.94836 |
Chemical Identifiers
| CAS Number | 876575-60-9 |
|---|---|
| SMILES | C1COC2=C(O1)C=CC(=C2)/C=C/3\C(=O)N(C(=S)S3)CCCCCC(=O)O |
Product Overview
AC1MBBCX (CAS 876575-60-9), with molecular formula C18H19NO5S2 and molecular weight 393.07047 g/mol. IUPAC: 6-[(5E)-5-(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid.