2-(4-tert-butylphenyl)-5-[(2,3-dimethoxyphenyl)methylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
2-(4-tert-butylphenyl)-5-[(2,3-dimethoxyphenyl)methylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
2-(4-tert-butylphenyl)-5-[(2,3-dimethoxyphenyl)methylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | 5629-0595 |
| Compound Name: | 2-(4-tert-butylphenyl)-5-[(2,3-dimethoxyphenyl)methylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 421.52 |
| Molecular Formula: | C23 H23 N3 O3 S |
| Smiles: | [H]C(=C1/C(n2c(nc(c3ccc(cc3)C(C)(C)C)n2)S1)=O)\c1cccc(c1OC)OC |
| Stereo: | ACHIRAL |
| logP: | 5.814 |
| logD: | 5.814 |
| logSw: | -5.5892 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.543 |
| InChI Key: | ALNBNOMKSRDESC-UHFFFAOYSA-N |