4-[(6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene)methyl]phenyl acetate
Chemical Structure Depiction of
4-[(6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene)methyl]phenyl acetate
4-[(6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene)methyl]phenyl acetate
Compound characteristics
| Compound ID: | 5629-0491 |
| Compound Name: | 4-[(6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene)methyl]phenyl acetate |
| Molecular Weight: | 287.29 |
| Molecular Formula: | C13 H9 N3 O3 S |
| Smiles: | [H]C(=C1/C(n2c(nc([H])n2)S1)=O)\c1ccc(cc1)OC(C)=O |
| Stereo: | ACHIRAL |
| logP: | 1.386 |
| logD: | 1.386 |
| logSw: | -2.0296 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.16 |
| InChI Key: | UYQQUCAHDOTULG-UHFFFAOYSA-N |