ethyl 4-[6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methylhex-4-enoyl]piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-[6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methylhex-4-enoyl]piperazine-1-carboxylate
ethyl 4-[6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methylhex-4-enoyl]piperazine-1-carboxylate
Compound characteristics
| Compound ID: | Y043-5060 |
| Compound Name: | ethyl 4-[6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methylhex-4-enoyl]piperazine-1-carboxylate |
| Molecular Weight: | 460.53 |
| Molecular Formula: | C24 H32 N2 O7 |
| Smiles: | CCOC(N1CCN(CC1)C(CCC(\C)=C\Cc1c(c2C(=O)OCc2c(C)c1OC)O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7707 |
| logD: | 3.7701 |
| logSw: | -4.1347 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.908 |
| InChI Key: | TYBAIZOSECTGOD-UHFFFAOYSA-N |