6-benzyl-2-[(5-bromo-2-methoxyphenyl)methylidene]-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
Chemical Structure Depiction of
6-benzyl-2-[(5-bromo-2-methoxyphenyl)methylidene]-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
6-benzyl-2-[(5-bromo-2-methoxyphenyl)methylidene]-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
Compound characteristics
| Compound ID: | 5629-1162 |
| Compound Name: | 6-benzyl-2-[(5-bromo-2-methoxyphenyl)methylidene]-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione |
| Molecular Weight: | 456.32 |
| Molecular Formula: | C20 H14 Br N3 O3 S |
| Smiles: | [H]C(=C1/C(N2C(=NC(C(Cc3ccccc3)=N2)=O)S1)=O)\c1cc(ccc1OC)[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.0844 |
| logD: | 4.0844 |
| logSw: | -4.3921 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.182 |
| InChI Key: | SPSMLZUKNIEBNV-UHFFFAOYSA-N |