2-methoxy-4-{[6-oxo-2-(thiophen-2-yl)[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]methyl}phenyl acetate
Chemical Structure Depiction of
2-methoxy-4-{[6-oxo-2-(thiophen-2-yl)[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]methyl}phenyl acetate
2-methoxy-4-{[6-oxo-2-(thiophen-2-yl)[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]methyl}phenyl acetate
Compound characteristics
| Compound ID: | 5629-0480 |
| Compound Name: | 2-methoxy-4-{[6-oxo-2-(thiophen-2-yl)[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]methyl}phenyl acetate |
| Molecular Weight: | 399.45 |
| Molecular Formula: | C18 H13 N3 O4 S2 |
| Smiles: | [H]C(=C1/C(n2c(nc(c3cccs3)n2)S1)=O)\c1ccc(c(c1)OC)OC(C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3237 |
| logD: | 3.3237 |
| logSw: | -3.709 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 66.682 |
| InChI Key: | IIGNGELQWBLYNY-UHFFFAOYSA-N |