6-[(4-fluorophenyl)methyl]-2-[(3,4,5-trimethoxyphenyl)methylidene]-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
Chemical Structure Depiction of
6-[(4-fluorophenyl)methyl]-2-[(3,4,5-trimethoxyphenyl)methylidene]-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
6-[(4-fluorophenyl)methyl]-2-[(3,4,5-trimethoxyphenyl)methylidene]-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
Compound characteristics
| Compound ID: | C451-0139 |
| Compound Name: | 6-[(4-fluorophenyl)methyl]-2-[(3,4,5-trimethoxyphenyl)methylidene]-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione |
| Molecular Weight: | 455.46 |
| Molecular Formula: | C22 H18 F N3 O5 S |
| Smiles: | COc1cc(\C=C2/C(N3C(=NC(C(Cc4ccc(cc4)F)=N3)=O)S2)=O)cc(c1OC)OC |
| Stereo: | ACHIRAL |
| logP: | 2.8905 |
| logD: | 2.8905 |
| logSw: | -3.2937 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 73.53 |
| InChI Key: | PVVAISTWMRYPSS-UHFFFAOYSA-N |