3-(4-ethoxyphenyl)-7-[(5-iodofuran-2-yl)methylidene]-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
Chemical Structure Depiction of
3-(4-ethoxyphenyl)-7-[(5-iodofuran-2-yl)methylidene]-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
3-(4-ethoxyphenyl)-7-[(5-iodofuran-2-yl)methylidene]-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
Compound characteristics
| Compound ID: | 4268-0006 |
| Compound Name: | 3-(4-ethoxyphenyl)-7-[(5-iodofuran-2-yl)methylidene]-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one |
| Molecular Weight: | 481.31 |
| Molecular Formula: | C18 H16 I N3 O3 S |
| Smiles: | CCOc1ccc(cc1)N1CN=C2N(C1)C(/C(=C\c1ccc(o1)I)S2)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4416 |
| logD: | 5.4322 |
| logSw: | -5.3168 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.661 |
| InChI Key: | QYSPTCIAFAKEFH-UHFFFAOYSA-N |