2-bromo-6-methoxy-4-[(6-methyl-3,7-dioxo-7H-[1,3]thiazolo[3,2-b][1,2,4]triazin-2(3H)-ylidene)methyl]phenyl acetate
Chemical Structure Depiction of
2-bromo-6-methoxy-4-[(6-methyl-3,7-dioxo-7H-[1,3]thiazolo[3,2-b][1,2,4]triazin-2(3H)-ylidene)methyl]phenyl acetate
2-bromo-6-methoxy-4-[(6-methyl-3,7-dioxo-7H-[1,3]thiazolo[3,2-b][1,2,4]triazin-2(3H)-ylidene)methyl]phenyl acetate
Compound characteristics
| Compound ID: | 5629-1157 |
| Compound Name: | 2-bromo-6-methoxy-4-[(6-methyl-3,7-dioxo-7H-[1,3]thiazolo[3,2-b][1,2,4]triazin-2(3H)-ylidene)methyl]phenyl acetate |
| Molecular Weight: | 438.25 |
| Molecular Formula: | C16 H12 Br N3 O5 S |
| Smiles: | [H]C(=C1/C(N2C(=NC(C(C)=N2)=O)S1)=O)\c1cc(c(c(c1)[Br])OC(C)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 1.8357 |
| logD: | 1.8357 |
| logSw: | -2.0813 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 78.648 |
| InChI Key: | YOXDZOIXMFYWRJ-UHFFFAOYSA-N |