5-[(2,5-dimethoxyphenyl)methylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
5-[(2,5-dimethoxyphenyl)methylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
5-[(2,5-dimethoxyphenyl)methylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | 5629-0627 |
| Compound Name: | 5-[(2,5-dimethoxyphenyl)methylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 289.31 |
| Molecular Formula: | C13 H11 N3 O3 S |
| Smiles: | [H]C(=C1/C(n2c(nc([H])n2)S1)=O)\c1cc(ccc1OC)OC |
| Stereo: | ACHIRAL |
| logP: | 2.1439 |
| logD: | 2.1439 |
| logSw: | -2.734 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.583 |
| InChI Key: | ICIUFIALYVSQMQ-UHFFFAOYSA-N |