5-{[3-(4-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-(2-phenylethenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
5-{[3-(4-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-(2-phenylethenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
5-{[3-(4-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-(2-phenylethenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | Y070-3112 |
| Compound Name: | 5-{[3-(4-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-(2-phenylethenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 487.58 |
| Molecular Formula: | C29 H21 N5 O S |
| Smiles: | Cc1ccc(cc1)c1c(/C=C2/C(n3c(nc(/C=C/c4ccccc4)n3)S2)=O)cn(c2ccccc2)n1 |
| Stereo: | ACHIRAL |
| logP: | 6.2309 |
| logD: | 6.2309 |
| logSw: | -5.6059 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.819 |
| InChI Key: | BLNCKLNFTIJYQE-UHFFFAOYSA-N |