7-{[(1-benzyl-1H-benzimidazol-2-yl)sulfanyl]methyl}-4,5,6-triethoxy-2-benzofuran-1(3H)-one
Chemical Structure Depiction of
7-{[(1-benzyl-1H-benzimidazol-2-yl)sulfanyl]methyl}-4,5,6-triethoxy-2-benzofuran-1(3H)-one
7-{[(1-benzyl-1H-benzimidazol-2-yl)sulfanyl]methyl}-4,5,6-triethoxy-2-benzofuran-1(3H)-one
Compound characteristics
| Compound ID: | 8019-8983 |
| Compound Name: | 7-{[(1-benzyl-1H-benzimidazol-2-yl)sulfanyl]methyl}-4,5,6-triethoxy-2-benzofuran-1(3H)-one |
| Molecular Weight: | 518.63 |
| Molecular Formula: | C29 H30 N2 O5 S |
| Smiles: | CCOc1c2COC(c2c(CSc2nc3ccccc3n2Cc2ccccc2)c(c1OCC)OCC)=O |
| Stereo: | ACHIRAL |
| logP: | 6.7822 |
| logD: | 6.7809 |
| logSw: | -5.7916 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 54.94 |
| InChI Key: | DVNRBIVIUHDOKA-UHFFFAOYSA-N |