AC1LYP6I
(5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-3-(2-methylphenyl)-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: AB00099893-01|(5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-3-(2-methylphenyl)-2-thioxo-1,3-thiazolidin-4-one|(Z)-5-(benzo[d][1,3]dioxol-5-ylmethylene)-2-thioxo-3-(o-tolyl)thiazolidin-4-one|(5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-3-(2-methylphenyl)-2-sulfanylidene-1,3-thiazolidin-4-one|5-(2H-benzo[3,4-d]1,3-dioxolen-5-ylmethylene)-3-(2-methylphenyl)-2-thioxo-1,3- thiazolidin-4-one
| Molecular Formula | C18H13NO3S2 |
|---|---|
| Molecular Weight | 355.0337 g/mol |
| LogP | 4.12952 |
| Topological Polar Surface Area | 38.77 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 355.0337 |
| Monoisotopic Mass | 355.0337 |
| Heavy Atoms | 24 |
| Complexity | 891.58264 |
Chemical Identifiers
| CAS Number | 300674-75-3 |
|---|---|
| SMILES | CC1=CC=CC=C1N2C(=O)/C(=C/C3=CC4=C(C=C3)OCO4)/SC2=S |
Product Overview
AC1LYP6I (CAS 300674-75-3), with molecular formula C18H13NO3S2 and molecular weight 355.0337 g/mol. IUPAC: (5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-3-(2-methylphenyl)-2-sulfanylidene-1,3-thiazolidin-4-one.
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