5-[(3-bromophenyl)methylidene]-2-(4-chlorophenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
5-[(3-bromophenyl)methylidene]-2-(4-chlorophenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
5-[(3-bromophenyl)methylidene]-2-(4-chlorophenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | Y070-0713 |
| Compound Name: | 5-[(3-bromophenyl)methylidene]-2-(4-chlorophenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 418.7 |
| Molecular Formula: | C17 H9 Br Cl N3 O S |
| Smiles: | C(=C1/C(n2c(nc(c3ccc(cc3)[Cl])n2)S1)=O)\c1cccc(c1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 5.4682 |
| logD: | 5.4682 |
| logSw: | -6.249 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.196 |
| InChI Key: | MRYSMLLWFIEJCH-UHFFFAOYSA-N |