2-{[3-(3-butoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
Chemical Structure Depiction of
2-{[3-(3-butoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
2-{[3-(3-butoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
Compound characteristics
| Compound ID: | Y070-2182 |
| Compound Name: | 2-{[3-(3-butoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one |
| Molecular Weight: | 492.6 |
| Molecular Formula: | C29 H24 N4 O2 S |
| Smiles: | CCCCOc1cccc(c1)c1c(/C=C2/C(n3c4ccccc4nc3S2)=O)cn(c2ccccc2)n1 |
| Stereo: | ACHIRAL |
| logP: | 6.7687 |
| logD: | 6.7687 |
| logSw: | -5.5744 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.503 |
| InChI Key: | UKSMSPOERKFDJT-UHFFFAOYSA-N |