2-[(5-bromo-2-methoxyphenyl)methylidene]-6-[(4-methylphenyl)methyl]-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
Chemical Structure Depiction of
2-[(5-bromo-2-methoxyphenyl)methylidene]-6-[(4-methylphenyl)methyl]-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
2-[(5-bromo-2-methoxyphenyl)methylidene]-6-[(4-methylphenyl)methyl]-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
Compound characteristics
| Compound ID: | C451-0043 |
| Compound Name: | 2-[(5-bromo-2-methoxyphenyl)methylidene]-6-[(4-methylphenyl)methyl]-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione |
| Molecular Weight: | 470.34 |
| Molecular Formula: | C21 H16 Br N3 O3 S |
| Smiles: | [H]C(=C1/C(N2C(=NC(C(Cc3ccc(C)cc3)=N2)=O)S1)=O)\c1cc(ccc1OC)[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.5078 |
| logD: | 4.5078 |
| logSw: | -4.4614 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.182 |
| InChI Key: | CNXMXRDVQMTVEP-UHFFFAOYSA-N |