ethyl N-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylfuran-3-carbonyl]valinate
Chemical Structure Depiction of
ethyl N-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylfuran-3-carbonyl]valinate
ethyl N-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylfuran-3-carbonyl]valinate
Compound characteristics
| Compound ID: | 8016-2794 |
| Compound Name: | ethyl N-[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylfuran-3-carbonyl]valinate |
| Molecular Weight: | 387.43 |
| Molecular Formula: | C21 H25 N O6 |
| Smiles: | CCOC(C(C(C)C)NC(c1cc(c2ccc3c(c2)OCCO3)oc1C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3464 |
| logD: | 3.3464 |
| logSw: | -3.47 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.906 |
| InChI Key: | ZGWVOOZWKCAAIN-IBGZPJMESA-N |