5-{[5-(4-acetylphenyl)furan-2-yl]methylidene}-2-(4-ethoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
5-{[5-(4-acetylphenyl)furan-2-yl]methylidene}-2-(4-ethoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
5-{[5-(4-acetylphenyl)furan-2-yl]methylidene}-2-(4-ethoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | 5629-0056 |
| Compound Name: | 5-{[5-(4-acetylphenyl)furan-2-yl]methylidene}-2-(4-ethoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 457.51 |
| Molecular Formula: | C25 H19 N3 O4 S |
| Smiles: | [H]C(=C1/C(n2c(nc(c3ccc(cc3)OCC)n2)S1)=O)\c1ccc(c2ccc(cc2)C(C)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 5.3155 |
| logD: | 5.3155 |
| logSw: | -5.2549 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.716 |
| InChI Key: | VDZXSPFCUJEQGP-UHFFFAOYSA-N |