6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methyl-N-[4-(pyridin-2-yl)-1,3-thiazol-2-yl]hex-4-enamide
Chemical Structure Depiction of
6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methyl-N-[4-(pyridin-2-yl)-1,3-thiazol-2-yl]hex-4-enamide
6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methyl-N-[4-(pyridin-2-yl)-1,3-thiazol-2-yl]hex-4-enamide
Compound characteristics
| Compound ID: | Y043-4888 |
| Compound Name: | 6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methyl-N-[4-(pyridin-2-yl)-1,3-thiazol-2-yl]hex-4-enamide |
| Molecular Weight: | 479.55 |
| Molecular Formula: | C25 H25 N3 O5 S |
| Smiles: | C/C(CCC(Nc1nc(cs1)c1ccccn1)=O)=C\Cc1c(c2C(=O)OCc2c(C)c1OC)O |
| Stereo: | ACHIRAL |
| logP: | 5.1493 |
| logD: | 5.1486 |
| logSw: | -5.0177 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.708 |
| InChI Key: | HTQFKPTWQLQKNH-UHFFFAOYSA-N |