5-[(4-nitrophenyl)methylidene]-2-(4-propoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
5-[(4-nitrophenyl)methylidene]-2-(4-propoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
5-[(4-nitrophenyl)methylidene]-2-(4-propoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | 6187-0846 |
| Compound Name: | 5-[(4-nitrophenyl)methylidene]-2-(4-propoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 408.43 |
| Molecular Formula: | C20 H16 N4 O4 S |
| Smiles: | CCCOc1ccc(cc1)c1nc2n(C(/C(=C/c3ccc(cc3)[N+]([O-])=O)S2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.9763 |
| logD: | 4.9763 |
| logSw: | -4.584 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 77.995 |
| InChI Key: | CTCRQEJWSMQTHI-UHFFFAOYSA-N |