2-(4-chlorophenyl)-5-{[3-(4-fluorophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
2-(4-chlorophenyl)-5-{[3-(4-fluorophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
2-(4-chlorophenyl)-5-{[3-(4-fluorophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | Y070-0263 |
| Compound Name: | 2-(4-chlorophenyl)-5-{[3-(4-fluorophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 499.95 |
| Molecular Formula: | C26 H15 Cl F N5 O S |
| Smiles: | C(=C1/C(n2c(nc(c3ccc(cc3)[Cl])n2)S1)=O)\c1cn(c2ccccc2)nc1c1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 6.3112 |
| logD: | 6.3112 |
| logSw: | -6.3617 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.829 |
| InChI Key: | ZFZFCPBXAYIGSO-UHFFFAOYSA-N |