5-{[5-(3-bromophenyl)furan-2-yl]methylidene}-2-(3,4,5-trimethoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
5-{[5-(3-bromophenyl)furan-2-yl]methylidene}-2-(3,4,5-trimethoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
5-{[5-(3-bromophenyl)furan-2-yl]methylidene}-2-(3,4,5-trimethoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | 6187-1574 |
| Compound Name: | 5-{[5-(3-bromophenyl)furan-2-yl]methylidene}-2-(3,4,5-trimethoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 540.39 |
| Molecular Formula: | C24 H18 Br N3 O5 S |
| Smiles: | [H]C(=C1/C(n2c(nc(c3cc(c(c(c3)OC)OC)OC)n2)S1)=O)\c1ccc(c2cccc(c2)[Br])o1 |
| Stereo: | ACHIRAL |
| logP: | 5.6406 |
| logD: | 5.6406 |
| logSw: | -5.5768 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.744 |
| InChI Key: | WNDQWYQLGXGLKI-UHFFFAOYSA-N |