2-(3-methyl-1-benzofuran-2-yl)-5-{[1-phenyl-3-(thiophen-2-yl)-1H-pyrazol-4-yl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
2-(3-methyl-1-benzofuran-2-yl)-5-{[1-phenyl-3-(thiophen-2-yl)-1H-pyrazol-4-yl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
2-(3-methyl-1-benzofuran-2-yl)-5-{[1-phenyl-3-(thiophen-2-yl)-1H-pyrazol-4-yl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | 5629-2023 |
| Compound Name: | 2-(3-methyl-1-benzofuran-2-yl)-5-{[1-phenyl-3-(thiophen-2-yl)-1H-pyrazol-4-yl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 507.59 |
| Molecular Formula: | C27 H17 N5 O2 S2 |
| Smiles: | [H]C(=C1/C(n2c(nc(c3c(C)c4ccccc4o3)n2)S1)=O)\c1cn(c2ccccc2)nc1c1cccs1 |
| Stereo: | ACHIRAL |
| logP: | 6.5479 |
| logD: | 6.5479 |
| logSw: | -5.923 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 61.373 |
| InChI Key: | YWMNOQYEKIGFCP-UHFFFAOYSA-N |