2-[6-oxo-5-(3-phenylprop-2-en-1-ylidene)-5,6-dihydro[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl]phenyl acetate
Chemical Structure Depiction of
2-[6-oxo-5-(3-phenylprop-2-en-1-ylidene)-5,6-dihydro[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl]phenyl acetate
2-[6-oxo-5-(3-phenylprop-2-en-1-ylidene)-5,6-dihydro[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl]phenyl acetate
Compound characteristics
| Compound ID: | 5629-1030 |
| Compound Name: | 2-[6-oxo-5-(3-phenylprop-2-en-1-ylidene)-5,6-dihydro[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl]phenyl acetate |
| Molecular Weight: | 389.43 |
| Molecular Formula: | C21 H15 N3 O3 S |
| Smiles: | [H]C(\C=C/c1ccccc1)=C1/C(n2c(nc(c3ccccc3OC(C)=O)n2)S1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0825 |
| logD: | 4.0825 |
| logSw: | -4.5258 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.034 |
| InChI Key: | WJMXIVZBZBHGCG-UHFFFAOYSA-N |