6-benzyl-2-[(4-ethoxy-3-methoxyphenyl)methylidene]-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
Chemical Structure Depiction of
6-benzyl-2-[(4-ethoxy-3-methoxyphenyl)methylidene]-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
6-benzyl-2-[(4-ethoxy-3-methoxyphenyl)methylidene]-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
Compound characteristics
| Compound ID: | 5629-1147 |
| Compound Name: | 6-benzyl-2-[(4-ethoxy-3-methoxyphenyl)methylidene]-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione |
| Molecular Weight: | 421.47 |
| Molecular Formula: | C22 H19 N3 O4 S |
| Smiles: | [H]C(=C1/C(N2C(=NC(C(Cc3ccccc3)=N2)=O)S1)=O)\c1ccc(c(c1)OC)OCC |
| Stereo: | ACHIRAL |
| logP: | 3.0565 |
| logD: | 3.0565 |
| logSw: | -3.2965 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.393 |
| InChI Key: | NERYGUCMQAESAQ-UHFFFAOYSA-N |